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

Systemtic Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(4-phenylbutan-2-yl)piperidine-4-carboxamide Openeye Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(1-methyl-3-phenyl-propyl)piperidine-4-carboxamide CAS Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(4-phenylbutan-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(4-phenylbutan-2-yl)piperidine-4-carboxamide Traditional Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(1-methyl-3-phenyl-propyl)isonipecotamide Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCC(CC3)C(=O)NC(C)CCC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCC(CC3)C(=O)NC(C)CCC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O2S/c1-3-30-21-11-12-22-23(17-21)31-25(27-22)28-15-13-20(14-16-28)24(29)26-18(2)9-10-19-7-5-4-6-8-19/h4-8,11-12,17-18,20H,3,9-10,13-16H2,1-2H3,(H,26,29)