N-(5-chloranyl-2-methyl-phenyl)-1-(4-methylpyrimidin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-1-(4-methylpyrimidin-2-yl)piperidine-4-carboxamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-1-(4-methylpyrimidin-2-yl)piperidine-4-carboxamide CAS Name: N-(5-chloro-2-methylphenyl)-1-(4-methyl-2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-methylphenyl)-1-(4-methylpyrimidin-2-yl)piperidine-4-carboxamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-1-(4-methylpyrimidin-2-yl)isonipecotamide Formula: C18H21ClN4O MolecularWeight: 344.83854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)C2CCN(CC2)C3=NC=CC(=N3)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)C2CCN(CC2)C3=NC=CC(=N3)C

InChI

InChI=1S/C18H21ClN4O/c1-12-3-4-15(19)11-16(12)22-17(24)14-6-9-23(10-7-14)18-20-8-5-13(2)21-18/h3-5,8,11,14H,6-7,9-10H2,1-2H3,(H,22,24)