3-(1-methylpyrazol-4-yl)-1-[(3S)-3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]propan-1-one

Systemtic Name: 3-(1-methylpyrazol-4-yl)-1-[(3S)-3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]propan-1-one Openeye Name: 1-[(3S)-3-(4-isopropylanilino)-1-piperidyl]-3-(1-methylpyrazol-4-yl)propan-1-one CAS Name: 3-(1-methyl-4-pyrazolyl)-1-[(3S)-3-(4-propan-2-ylanilino)-1-piperidinyl]-1-propanone IUPAC Name: 3-(1-methylpyrazol-4-yl)-1-[(3S)-3-(4-propan-2-ylanilino)piperidin-1-yl]propan-1-one Traditional Name: 1-[(3S)-3-cumidinopiperidino]-3-(1-methylpyrazol-4-yl)propan-1-one Formula: C21H30N4O MolecularWeight: 354.4891

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2CCCN(C2)C(=O)CCC3=CN(N=C3)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N[C@H]2CCCN(C2)C(=O)CCC3=CN(N=C3)C

InChI

InChI=1S/C21H30N4O/c1-16(2)18-7-9-19(10-8-18)23-20-5-4-12-25(15-20)21(26)11-6-17-13-22-24(3)14-17/h7-10,13-14,16,20,23H,4-6,11-12,15H2,1-3H3/t20-/m0/s1