3-acetamido-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)propanamide

Systemtic Name: 3-acetamido-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)propanamide Openeye Name: 3-acetamido-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(p-tolyl)propanamide CAS Name: 3-acetamido-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)propanamide IUPAC Name: 3-acetamido-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methylphenyl)propanamide Traditional Name: 3-acetamido-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(p-tolyl)propionamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)NC2=NC3=C(C=C(C=C3S2)C)C)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)NC2=NC3=C(C=C(C=C3S2)C)C)NC(=O)C

InChI

InChI=1S/C21H23N3O2S/c1-12-5-7-16(8-6-12)17(22-15(4)25)11-19(26)23-21-24-20-14(3)9-13(2)10-18(20)27-21/h5-10,17H,11H2,1-4H3,(H,22,25)(H,23,24,26)