4-(4-chlorophenyl)sulfonyl-N-(4,7-dimethoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)butanamide

Systemtic Name: 4-(4-chlorophenyl)sulfonyl-N-(4,7-dimethoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)butanamide Openeye Name: N-(3-allyl-4,7-dimethoxy-1,3-benzothiazol-2-ylidene)-4-(4-chlorophenyl)sulfonyl-butanamide CAS Name: 4-(4-chlorophenyl)sulfonyl-N-(4,7-dimethoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)butanamide IUPAC Name: 4-(4-chlorophenyl)sulfonyl-N-(4,7-dimethoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: N-(3-allyl-4,7-dimethoxy-1,3-benzothiazol-2-ylidene)-4-(4-chlorophenyl)sulfonyl-butyramide Formula: C22H23ClN2O5S2 MolecularWeight: 495.01142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)Cl)N2CC=C

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)Cl)N2CC=C

InChI

InChI=1S/C22H23ClN2O5S2/c1-4-13-25-20-17(29-2)11-12-18(30-3)21(20)31-22(25)24-19(26)6-5-14-32(27,28)16-9-7-15(23)8-10-16/h4,7-12H,1,5-6,13-14H2,2-3H3