4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(3-methylphenyl)pentanamide

Systemtic Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(3-methylphenyl)pentanamide Openeye Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(m-tolyl)pentanamide CAS Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(3-methylphenyl)pentanamide IUPAC Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(3-methylphenyl)pentanamide Traditional Name: 4-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]-N-(m-tolyl)valeramide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(CC(C)C)NS(=O)(=O)C2=CC3=C(C=C2)N=C(S3)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C(CC(C)C)NS(=O)(=O)C2=CC3=C(C=C2)N=C(S3)C

InChI

InChI=1S/C21H25N3O3S2/c1-13(2)10-19(21(25)23-16-7-5-6-14(3)11-16)24-29(26,27)17-8-9-18-20(12-17)28-15(4)22-18/h5-9,11-13,19,24H,10H2,1-4H3,(H,23,25)