6-azanyl-5-chloranyl-2-oxidanylidene-N-[[1-(2-phenylsulfanylethyl)piperidin-4-yl]methyl]-1H-pyridine-3-carboxamide

Systemtic Name: 6-azanyl-5-chloranyl-2-oxidanylidene-N-[[1-(2-phenylsulfanylethyl)piperidin-4-yl]methyl]-1H-pyridine-3-carboxamide Openeye Name: 6-amino-5-chloro-2-oxo-N-[[1-(2-phenylsulfanylethyl)-4-piperidyl]methyl]-1H-pyridine-3-carboxamide CAS Name: 6-amino-5-chloro-2-oxo-N-[[1-[2-(phenylthio)ethyl]-4-piperidinyl]methyl]-1H-pyridine-3-carboxamide IUPAC Name: 6-amino-5-chloro-2-oxo-N-[[1-(2-phenylsulfanylethyl)piperidin-4-yl]methyl]-1H-pyridine-3-carboxamide Traditional Name: 6-amino-5-chloro-2-keto-N-[[1-[2-(phenylthio)ethyl]-4-piperidyl]methyl]-1H-pyridine-3-carboxamide Formula: C20H25ClN4O2S MolecularWeight: 420.9561

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C2=CC(=C(NC2=O)N)Cl)CCSC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1CNC(=O)C2=CC(=C(NC2=O)N)Cl)CCSC3=CC=CC=C3

InChI

InChI=1S/C20H25ClN4O2S/c21-17-12-16(20(27)24-18(17)22)19(26)23-13-14-6-8-25(9-7-14)10-11-28-15-4-2-1-3-5-15/h1-5,12,14H,6-11,13H2,(H,23,26)(H3,22,24,27)