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(Z)-1-carbamoyl-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}methanecarbohydrazonoyl cyanide

(Z)-1-carbamoyl-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}methanecarbohydrazonoyl cyanide

Formula: C15H15N7O3S

SMILES: CC1=CC(C)=NC(NS(=O)(=O)C2=CC=C(NN=C(C#N)C(N)=O)C=C2)=N1

IUPAC: (Z)-1-carbamoyl-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}methanecarbohydrazonoyl cyanide

InChI: InChI=1S/C15H15N7O3S/c1-9-7-10(2)19-15(18-9)22-26(24,25)12-5-3-11(4-6-12)20-21-13(8-16)14(17)23/h3-7,20H,1-2H3,(H2,17,23)(H,18,19,22)/b21-13-

Composition: C (48.25%), H (4.05%), N (26.26%), O (12.85%), S (8.59%)

Molar Mass: 373.39

Atom Count: 41

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 373.095708545
Formal Charge 0
FSP3 0.13
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 8
Hydrogen Bond Donor Count 3
InChIKey OAAPVASPKVKYLU-BKUYFWCQSA-N
Lipinski's Rule of Five 1
Molar Refractivity 94.95
Topological Polar Surface Area 163.22
Polarizability 35.5
Ring Count 2
Rotatable Bond Count 5

Suppliers

Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C15H15N7O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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