3-(4-chlorophenyl)-2-sulfanylidene-1,3-thiazepan-4-one

Systemtic Name: 3-(4-chlorophenyl)-2-sulfanylidene-1,3-thiazepan-4-one Openeye Name: 3-(4-chlorophenyl)-2-thioxo-1,3-thiazepan-4-one CAS Name: 3-(4-chlorophenyl)-2-sulfanylidene-1,3-thiazepan-4-one IUPAC Name: 3-(4-chlorophenyl)-2-sulfanylidene-1,3-thiazepan-4-one Traditional Name: 3-(4-chlorophenyl)-2-thioxo-1,3-thiazepan-4-one Formula: C11H10ClNOS2 MolecularWeight: 271.7862

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C(=S)SC1)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1CC(=O)N(C(=S)SC1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C11H10ClNOS2/c12-8-3-5-9(6-4-8)13-10(14)2-1-7-16-11(13)15/h3-6H,1-2,7H2