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(5E)-5-({4-[(4-chlorophenyl)sulfanyl]phenyl}methylidene)-2-sulfanylideneimidazolidin-4-one

(5E)-5-({4-[(4-chlorophenyl)sulfanyl]phenyl}methylidene)-2-sulfanylideneimidazolidin-4-one

Formula: C16H11ClN2OS2

SMILES: ClC1=CC=C(SC2=CC=C(C=C3NC(=S)NC3=O)C=C2)C=C1

IUPAC: (5E)-5-({4-[(4-chlorophenyl)sulfanyl]phenyl}methylidene)-2-sulfanylideneimidazolidin-4-one

InChI: InChI=1S/C16H11ClN2OS2/c17-11-3-7-13(8-4-11)22-12-5-1-10(2-6-12)9-14-15(20)19-16(21)18-14/h1-9H,(H2,18,19,20,21)/b14-9+

Composition: C (55.41%), H (3.20%), Cl (10.22%), N (8.08%), O (4.61%), S (18.49%)

Molar Mass: 346.85

Atom Count: 33

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 346.000133
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 2
InChIKey NJJZAJAXHLNYTI-NTEUORMPSA-N
Lipinski's Rule of Five 1
Molar Refractivity 97.21
Topological Polar Surface Area 41.13
Polarizability 36.99
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H11ClN2OS2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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