N-(2-methyl-1,3-benzothiazol-6-yl)-1-(2-methylphenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(2-methylphenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(2-methylbenzoyl)piperidine-4-carboxamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-(2-methylbenzoyl)piperidine-4-carboxamide Traditional Name: N-(2-methyl-1,3-benzothiazol-6-yl)-1-o-toluoyl-isonipecotamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)N=C(S4)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)N=C(S4)C

InChI

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