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

Systemtic Name: 2-methyl-1-[4-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)carbonylpiperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-[1-phenyl-3-(2-thienyl)pyrazole-4-carbonyl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[oxo-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-(1-phenyl-3-thiophen-2-ylpyrazole-4-carbonyl)piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-[1-phenyl-3-(2-thienyl)pyrazole-4-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=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

InChI

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