2-methyl-1-[4-(2-phenyl-5-thiophen-2-yl-pyrazol-3-yl)carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-(2-phenyl-5-thiophen-2-yl-pyrazol-3-yl)carbonylpiperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-[2-phenyl-5-(2-thienyl)pyrazole-3-carbonyl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[oxo-(2-phenyl-5-thiophen-2-yl-3-pyrazolyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-(2-phenyl-5-thiophen-2-ylpyrazole-3-carbonyl)piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-[2-phenyl-5-(2-thienyl)pyrazole-3-carbonyl]piperazino]propan-1-one Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C22H24N4O2S/c1-16(2)21(27)24-10-12-25(13-11-24)22(28)19-15-18(20-9-6-14-29-20)23-26(19)17-7-4-3-5-8-17/h3-9,14-16H,10-13H2,1-2H3