(4-methoxyphenyl)-[(3S)-1-[(5-thiophen-2-yl-1H-pyrazol-3-yl)carbonyl]piperidin-3-yl]methanone

Systemtic Name: (4-methoxyphenyl)-[(3S)-1-[(5-thiophen-2-yl-1H-pyrazol-3-yl)carbonyl]piperidin-3-yl]methanone Openeye Name: (4-methoxyphenyl)-[(3S)-1-[5-(2-thienyl)-1H-pyrazole-3-carbonyl]-3-piperidyl]methanone CAS Name: (4-methoxyphenyl)-[(3S)-1-[oxo-(5-thiophen-2-yl-1H-pyrazol-3-yl)methyl]-3-piperidinyl]methanone IUPAC Name: (4-methoxyphenyl)-[(3S)-1-(5-thiophen-2-yl-1H-pyrazole-3-carbonyl)piperidin-3-yl]methanone Traditional Name: (4-methoxyphenyl)-[(3S)-1-[5-(2-thienyl)-1H-pyrazole-3-carbonyl]-3-piperidyl]methanone Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2CCCN(C2)C(=O)C3=NNC(=C3)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)[C@H]2CCCN(C2)C(=O)C3=NNC(=C3)C4=CC=CS4

InChI

InChI=1S/C21H21N3O3S/c1-27-16-8-6-14(7-9-16)20(25)15-4-2-10-24(13-15)21(26)18-12-17(22-23-18)19-5-3-11-28-19/h3,5-9,11-12,15H,2,4,10,13H2,1H3,(H,22,23)/t15-/m0/s1