(3S)-1-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperidine-3-carboxamide

Systemtic Name: (3S)-1-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperidine-3-carboxamide Openeye Name: (3S)-1-[1-phenyl-3-(p-tolyl)pyrazole-4-carbonyl]piperidine-3-carboxamide CAS Name: (3S)-1-[[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-[3-(4-methylphenyl)-1-phenylpyrazole-4-carbonyl]piperidine-3-carboxamide Traditional Name: (3S)-1-[1-phenyl-3-(p-tolyl)pyrazole-4-carbonyl]nipecotamide Formula: C23H24N4O2 MolecularWeight: 388.46226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)N3CCCC(C3)C(=O)N)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)N3CCC[C@@H](C3)C(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C23H24N4O2/c1-16-9-11-17(12-10-16)21-20(15-27(25-21)19-7-3-2-4-8-19)23(29)26-13-5-6-18(14-26)22(24)28/h2-4,7-12,15,18H,5-6,13-14H2,1H3,(H2,24,28)/t18-/m0/s1