[[3-(4-chlorophenyl)-4-(phenylsulfonyl)butanoyl]amino]carbamodithioic acid

Systemtic Name: [[3-(4-chlorophenyl)-4-(phenylsulfonyl)butanoyl]amino]carbamodithioic acid Openeye Name: [[4-(benzenesulfonyl)-3-(4-chlorophenyl)butanoyl]amino]carbamodithioic acid CAS Name: [[4-(benzenesulfonyl)-3-(4-chlorophenyl)-1-oxobutyl]amino]carbamodithioic acid IUPAC Name: [[4-(benzenesulfonyl)-3-(4-chlorophenyl)butanoyl]amino]carbamodithioic acid Traditional Name: [[4-besyl-3-(4-chlorophenyl)butanoyl]amino]carbamodithioic acid Formula: C17H17ClN2O3S3 MolecularWeight: 428.97648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC(CC(=O)NNC(=S)S)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC(CC(=O)NNC(=S)S)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H17ClN2O3S3/c18-14-8-6-12(7-9-14)13(10-16(21)19-20-17(24)25)11-26(22,23)15-4-2-1-3-5-15/h1-9,13H,10-11H2,(H,19,21)(H2,20,24,25)