(1-ethylpyrazol-4-yl)-[(3R)-3-[4-(2-methylphenyl)piperazin-1-yl]piperidin-1-yl]methanone

Systemtic Name: (1-ethylpyrazol-4-yl)-[(3R)-3-[4-(2-methylphenyl)piperazin-1-yl]piperidin-1-yl]methanone Openeye Name: (1-ethylpyrazol-4-yl)-[(3R)-3-[4-(o-tolyl)piperazin-1-yl]-1-piperidyl]methanone CAS Name: (1-ethyl-4-pyrazolyl)-[(3R)-3-[4-(2-methylphenyl)-1-piperazinyl]-1-piperidinyl]methanone IUPAC Name: (1-ethylpyrazol-4-yl)-[(3R)-3-[4-(2-methylphenyl)piperazin-1-yl]piperidin-1-yl]methanone Traditional Name: (1-ethylpyrazol-4-yl)-[(3R)-3-[4-(o-tolyl)piperazino]piperidino]methanone Formula: C22H31N5O MolecularWeight: 381.51444

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C(=O)N2CCCC(C2)N3CCN(CC3)C4=CC=CC=C4C

Isomeric SMILES

CCN1C=C(C=N1)C(=O)N2CCC[C@H](C2)N3CCN(CC3)C4=CC=CC=C4C

InChI

InChI=1S/C22H31N5O/c1-3-27-16-19(15-23-27)22(28)26-10-6-8-20(17-26)24-11-13-25(14-12-24)21-9-5-4-7-18(21)2/h4-5,7,9,15-16,20H,3,6,8,10-14,17H2,1-2H3/t20-/m1/s1