(3S)-1-(quinolin-5-ylmethyl)-N-[4-(1,3-thiazol-4-yl)phenyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(quinolin-5-ylmethyl)-N-[4-(1,3-thiazol-4-yl)phenyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(5-quinolylmethyl)-N-(4-thiazol-4-ylphenyl)piperidine-3-carboxamide CAS Name: (3S)-1-(5-quinolinylmethyl)-N-[4-(4-thiazolyl)phenyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(quinolin-5-ylmethyl)-N-[4-(1,3-thiazol-4-yl)phenyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(5-quinolylmethyl)-N-(4-thiazol-4-ylphenyl)nipecotamide Formula: C25H24N4OS MolecularWeight: 428.54926

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=C3C=CC=NC3=CC=C2)C(=O)NC4=CC=C(C=C4)C5=CSC=N5

Isomeric SMILES

C1C[C@@H](CN(C1)CC2=C3C=CC=NC3=CC=C2)C(=O)NC4=CC=C(C=C4)C5=CSC=N5

InChI

InChI=1S/C25H24N4OS/c30-25(28-21-10-8-18(9-11-21)24-16-31-17-27-24)20-5-3-13-29(15-20)14-19-4-1-7-23-22(19)6-2-12-26-23/h1-2,4,6-12,16-17,20H,3,5,13-15H2,(H,28,30)/t20-/m0/s1