3-(4-chlorophenyl)sulfonyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(4-chlorophenyl)sulfonyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(4-chlorophenyl)sulfonyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(4-chlorophenyl)sulfonyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(4-chlorophenyl)sulfonyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)propionamide Formula: C18H17ClN2O3S2 MolecularWeight: 408.92218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C18H17ClN2O3S2/c1-11-9-12(2)17-15(10-11)25-18(21-17)20-16(22)7-8-26(23,24)14-5-3-13(19)4-6-14/h3-6,9-10H,7-8H2,1-2H3,(H,20,21,22)