(3S)-N-[4-(2-methylimidazol-1-yl)phenyl]-1-[(2-methylpyrimidin-5-yl)methyl]piperidine-3-carboxamide

Systemtic Name: (3S)-N-[4-(2-methylimidazol-1-yl)phenyl]-1-[(2-methylpyrimidin-5-yl)methyl]piperidine-3-carboxamide Openeye Name: (3S)-N-[4-(2-methylimidazol-1-yl)phenyl]-1-[(2-methylpyrimidin-5-yl)methyl]piperidine-3-carboxamide CAS Name: (3S)-N-[4-(2-methyl-1-imidazolyl)phenyl]-1-[(2-methyl-5-pyrimidinyl)methyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-[4-(2-methylimidazol-1-yl)phenyl]-1-[(2-methylpyrimidin-5-yl)methyl]piperidine-3-carboxamide Traditional Name: (3S)-N-[4-(2-methylimidazol-1-yl)phenyl]-1-[(2-methylpyrimidin-5-yl)methyl]nipecotamide Formula: C22H26N6O MolecularWeight: 390.48144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=N1)CN2CCCC(C2)C(=O)NC3=CC=C(C=C3)N4C=CN=C4C

Isomeric SMILES

CC1=NC=C(C=N1)CN2CCC[C@@H](C2)C(=O)NC3=CC=C(C=C3)N4C=CN=C4C

InChI

InChI=1S/C22H26N6O/c1-16-24-12-18(13-25-16)14-27-10-3-4-19(15-27)22(29)26-20-5-7-21(8-6-20)28-11-9-23-17(28)2/h5-9,11-13,19H,3-4,10,14-15H2,1-2H3,(H,26,29)/t19-/m0/s1