(3S)-N-(4-chloranyl-2-methyl-phenyl)-3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carboxamide

Systemtic Name: (3S)-N-(4-chloranyl-2-methyl-phenyl)-3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carboxamide Openeye Name: (3S)-N-(4-chloro-2-methyl-phenyl)-3-[methyl-[2-(2-pyridyl)ethyl]amino]piperidine-1-carboxamide CAS Name: (3S)-N-(4-chloro-2-methylphenyl)-3-[methyl-[2-(2-pyridinyl)ethyl]amino]-1-piperidinecarboxamide IUPAC Name: (3S)-N-(4-chloro-2-methylphenyl)-3-[methyl(2-pyridin-2-ylethyl)amino]piperidine-1-carboxamide Traditional Name: (3S)-N-(4-chloro-2-methyl-phenyl)-3-[methyl-[2-(2-pyridyl)ethyl]amino]piperidine-1-carboxamide Formula: C21H27ClN4O MolecularWeight: 386.91828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=O)N2CCCC(C2)N(C)CCC3=CC=CC=N3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=O)N2CCC[C@@H](C2)N(C)CCC3=CC=CC=N3

InChI

InChI=1S/C21H27ClN4O/c1-16-14-17(22)8-9-20(16)24-21(27)26-12-5-7-19(15-26)25(2)13-10-18-6-3-4-11-23-18/h3-4,6,8-9,11,14,19H,5,7,10,12-13,15H2,1-2H3,(H,24,27)/t19-/m0/s1