4-(4-chlorophenyl)sulfonyl-N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide

Systemtic Name: 4-(4-chlorophenyl)sulfonyl-N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide Openeye Name: 4-(4-chlorophenyl)sulfonyl-N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide CAS Name: 4-(4-chlorophenyl)sulfonyl-N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide IUPAC Name: 4-(4-chlorophenyl)sulfonyl-N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: 4-(4-chlorophenyl)sulfonyl-N-(5,7-dimethyl-3-propargyl-1,3-benzothiazol-2-ylidene)butyramide Formula: C22H21ClN2O3S2 MolecularWeight: 460.99674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N(C(=NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)Cl)S2)CC#C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N(C(=NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)Cl)S2)CC#C)C

InChI

InChI=1S/C22H21ClN2O3S2/c1-4-11-25-19-14-15(2)13-16(3)21(19)29-22(25)24-20(26)6-5-12-30(27,28)18-9-7-17(23)8-10-18/h1,7-10,13-14H,5-6,11-12H2,2-3H3