4-(4-methoxyphenyl)sulfonyl-N-(6-methylsulfanyl-3-propyl-1,3-benzothiazol-2-ylidene)butanamide

Systemtic Name: 4-(4-methoxyphenyl)sulfonyl-N-(6-methylsulfanyl-3-propyl-1,3-benzothiazol-2-ylidene)butanamide Openeye Name: 4-(4-methoxyphenyl)sulfonyl-N-(6-methylsulfanyl-3-propyl-1,3-benzothiazol-2-ylidene)butanamide CAS Name: 4-(4-methoxyphenyl)sulfonyl-N-[6-(methylthio)-3-propyl-1,3-benzothiazol-2-ylidene]butanamide IUPAC Name: 4-(4-methoxyphenyl)sulfonyl-N-(6-methylsulfanyl-3-propyl-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: 4-(4-methoxyphenyl)sulfonyl-N-[6-(methylthio)-3-propyl-1,3-benzothiazol-2-ylidene]butyramide Formula: C22H26N2O4S3 MolecularWeight: 478.64784

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)SC)SC1=NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)SC)SC1=NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H26N2O4S3/c1-4-13-24-19-12-9-17(29-3)15-20(19)30-22(24)23-21(25)6-5-14-31(26,27)18-10-7-16(28-2)8-11-18/h7-12,15H,4-6,13-14H2,1-3H3