1-[(3R)-3-(3-methoxy-2-oxidanyl-phenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(4-methylpiperidin-1-yl)ethanone

Systemtic Name: 1-[(3R)-3-(3-methoxy-2-oxidanyl-phenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(4-methylpiperidin-1-yl)ethanone Openeye Name: 1-[(3R)-3-(2-hydroxy-3-methoxy-phenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-(4-methyl-1-piperidyl)ethanone CAS Name: 1-[(3R)-3-(2-hydroxy-3-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(4-methyl-1-piperidinyl)ethanone IUPAC Name: 1-[(3R)-3-(2-hydroxy-3-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-(4-methylpiperidin-1-yl)ethanone Traditional Name: 1-[(5R)-5-(2-hydroxy-3-methoxy-phenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]-2-(4-methylpiperidino)ethanone Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC(=O)N2C(CC(=N2)C3=CC=CS3)C4=C(C(=CC=C4)OC)O

Isomeric SMILES

CC1CCN(CC1)CC(=O)N2[C@H](CC(=N2)C3=CC=CS3)C4=C(C(=CC=C4)OC)O

InChI

InChI=1S/C22H27N3O3S/c1-15-8-10-24(11-9-15)14-21(26)25-18(13-17(23-25)20-7-4-12-29-20)16-5-3-6-19(28-2)22(16)27/h3-7,12,15,18,27H,8-11,13-14H2,1-2H3/t18-/m1/s1