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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)NC(=O)C2CCN(CC2)C3=NC4=C(C=C(C=C4S3)C)C

Isomeric SMILES

CCC(CC1=CC=CC=C1)NC(=O)C2CCN(CC2)C3=NC4=C(C=C(C=C4S3)C)C

InChI

InChI=1S/C25H31N3OS/c1-4-21(16-19-8-6-5-7-9-19)26-24(29)20-10-12-28(13-11-20)25-27-23-18(3)14-17(2)15-22(23)30-25/h5-9,14-15,20-21H,4,10-13,16H2,1-3H3,(H,26,29)