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

Systemtic Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(4-phenylbutan-2-yl)piperidine-4-carboxamide Openeye Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(1-methyl-3-phenyl-propyl)piperidine-4-carboxamide CAS Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(4-phenylbutan-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(4-phenylbutan-2-yl)piperidine-4-carboxamide Traditional Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(1-methyl-3-phenyl-propyl)isonipecotamide Formula: C25H31N3OS MolecularWeight: 421.59814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3CCC(CC3)C(=O)NC(C)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3CCC(CC3)C(=O)NC(C)CCC4=CC=CC=C4)C

InChI

InChI=1S/C25H31N3OS/c1-17-15-18(2)23-22(16-17)30-25(27-23)28-13-11-21(12-14-28)24(29)26-19(3)9-10-20-7-5-4-6-8-20/h4-8,15-16,19,21H,9-14H2,1-3H3,(H,26,29)