1-(2-methylphenyl)carbonyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(2-methylphenyl)carbonyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(2-methylbenzoyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-[(2-methylphenyl)-oxomethyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(2-methylbenzoyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-o-toluoyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)isonipecotamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC3=NC4=C(S3)CCCC4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC3=NC4=C(S3)CCCC4

InChI

InChI=1S/C21H25N3O2S/c1-14-6-2-3-7-16(14)20(26)24-12-10-15(11-13-24)19(25)23-21-22-17-8-4-5-9-18(17)27-21/h2-3,6-7,15H,4-5,8-13H2,1H3,(H,22,23,25)