(3-methylpiperidin-1-yl)-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methanone

Systemtic Name: (3-methylpiperidin-1-yl)-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methanone Openeye Name: [1-benzyl-3-(2-thienyl)pyrazol-4-yl]-(3-methyl-1-piperidyl)methanone CAS Name: (3-methyl-1-piperidinyl)-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]methanone IUPAC Name: (1-benzyl-3-thiophen-2-ylpyrazol-4-yl)-(3-methylpiperidin-1-yl)methanone Traditional Name: [1-benzyl-3-(2-thienyl)pyrazol-4-yl]-(3-methylpiperidino)methanone Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CC1CCCN(C1)C(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C21H23N3OS/c1-16-7-5-11-23(13-16)21(25)18-15-24(14-17-8-3-2-4-9-17)22-20(18)19-10-6-12-26-19/h2-4,6,8-10,12,15-16H,5,7,11,13-14H2,1H3