3-(4-chlorophenyl)sulfanyl-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)propanamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)propanamide CAS Name: 3-[(4-chlorophenyl)thio]-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)propanamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)propanamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-(6-mesyl-3-propyl-1,3-benzothiazol-2-ylidene)propionamide Formula: C20H21ClN2O3S3 MolecularWeight: 469.04034

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN2O3S3/c1-3-11-23-17-9-8-16(29(2,25)26)13-18(17)28-20(23)22-19(24)10-12-27-15-6-4-14(21)5-7-15/h4-9,13H,3,10-12H2,1-2H3