1-(3,4-dimethylphenyl)-5-piperidin-4-yl-N-(thiophen-2-ylmethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)-5-piperidin-4-yl-N-(thiophen-2-ylmethyl)pyrazole-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)-5-(4-piperidyl)-N-(2-thienylmethyl)pyrazole-4-carboxamide CAS Name: 1-(3,4-dimethylphenyl)-5-(4-piperidinyl)-N-(thiophen-2-ylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)-5-piperidin-4-yl-N-(thiophen-2-ylmethyl)pyrazole-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)-5-(4-piperidyl)-N-(2-thenyl)pyrazole-4-carboxamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(=O)NCC3=CC=CS3)C4CCNCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(=O)NCC3=CC=CS3)C4CCNCC4)C

InChI

InChI=1S/C22H26N4OS/c1-15-5-6-18(12-16(15)2)26-21(17-7-9-23-10-8-17)20(14-25-26)22(27)24-13-19-4-3-11-28-19/h3-6,11-12,14,17,23H,7-10,13H2,1-2H3,(H,24,27)