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3-benzyl-5-[(4-chlorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

3-benzyl-5-[(4-chlorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Formula: C17H12ClNOS2

SMILES: ClC1=CC=C(C=C2SC(=S)N(CC3=CC=CC=C3)C2=O)C=C1

IUPAC: 3-benzyl-5-[(4-chlorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

InChI: InChI=1S/C17H12ClNOS2/c18-14-8-6-12(7-9-14)10-15-16(20)19(17(21)22-15)11-13-4-2-1-3-5-13/h1-10H,11H2

Composition: C (59.04%), H (3.50%), Cl (10.25%), N (4.05%), O (4.63%), S (18.54%)

Molar Mass: 345.86

Atom Count: 34

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 345.0048841
Formal Charge 0
FSP3 0.06
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey SXKLQIXSAPAAII-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 98.53
Topological Polar Surface Area 20.31
Polarizability 37.79
Ring Count 3
Rotatable Bond Count 3

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Purity (%)
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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C17H12ClNOS2 Quote Only