1-cyclopropylcarbonyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-cyclopropylcarbonyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-(cyclopropanecarbonyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-[cyclopropyl(oxo)methyl]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-(cyclopropanecarbonyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: N-benzyl-1-(cyclopropanecarbonyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)isonipecotamide Formula: C26H29N3O2S MolecularWeight: 447.59236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4CCN(CC4)C(=O)C5CC5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4CCN(CC4)C(=O)C5CC5)C

InChI

InChI=1S/C26H29N3O2S/c1-17-14-18(2)23-22(15-17)32-26(27-23)29(16-19-6-4-3-5-7-19)25(31)21-10-12-28(13-11-21)24(30)20-8-9-20/h3-7,14-15,20-21H,8-13,16H2,1-2H3