[4-[[3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]carbonyl]piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-[[3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]carbonyl]piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[[3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]-oxomethyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazino]-(2-thienyl)methanone Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CS4)C

InChI

InChI=1S/C21H22N4O2S/c1-14-5-6-16(15(2)12-14)17-13-18(23-22-17)20(26)24-7-9-25(10-8-24)21(27)19-4-3-11-28-19/h3-6,11-13H,7-10H2,1-2H3,(H,22,23)