N-(4-methyl-1,3-benzothiazol-2-yl)-1-(2-methylphenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-(2-methylphenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-(2-methylbenzoyl)piperidine-4-carboxamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-(2-methylbenzoyl)piperidine-4-carboxamide Traditional Name: N-(4-methyl-1,3-benzothiazol-2-yl)-1-o-toluoyl-isonipecotamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4C

InChI

InChI=1S/C22H23N3O2S/c1-14-6-3-4-8-17(14)21(27)25-12-10-16(11-13-25)20(26)24-22-23-19-15(2)7-5-9-18(19)28-22/h3-9,16H,10-13H2,1-2H3,(H,23,24,26)