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3-benzyl-1-[(E)-[(4-chlorophenyl)methylidene]amino]thiourea

3-benzyl-1-[(E)-[(4-chlorophenyl)methylidene]amino]thiourea

Formula: C15H14ClN3S

SMILES: ClC1=CC=C(C=NNC(=S)NCC2=CC=CC=C2)C=C1

IUPAC: 3-benzyl-1-[(E)-[(4-chlorophenyl)methylidene]amino]thiourea

InChI: InChI=1S/C15H14ClN3S/c16-14-8-6-13(7-9-14)11-18-19-15(20)17-10-12-4-2-1-3-5-12/h1-9,11H,10H2,(H2,17,19,20)/b18-11+

Composition: C (59.30%), H (4.65%), Cl (11.67%), N (13.83%), S (10.55%)

Molar Mass: 303.81

Atom Count: 34

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 303.0596963
Formal Charge 0
FSP3 0.07
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey UWVBEHPXTIIOKK-WOJGMQOQSA-N
Lipinski's Rule of Five 1
Molar Refractivity 88.55
Topological Polar Surface Area 36.42
Polarizability 33.74
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C15H14ClN3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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