[4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-3-yl]-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-3-yl]-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone Openeye Name: [4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-3-yl]-[4-(2-thienylmethyl)piperazin-1-yl]methanone CAS Name: [4-(3,4-dimethoxyphenyl)-1-phenyl-3-pyrazolyl]-[4-(thiophen-2-ylmethyl)-1-piperazinyl]methanone IUPAC Name: [4-(3,4-dimethoxyphenyl)-1-phenylpyrazol-3-yl]-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone Traditional Name: [4-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-3-yl]-[4-(2-thenyl)piperazino]methanone Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN(N=C2C(=O)N3CCN(CC3)CC4=CC=CS4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN(N=C2C(=O)N3CCN(CC3)CC4=CC=CS4)C5=CC=CC=C5)OC

InChI

InChI=1S/C27H28N4O3S/c1-33-24-11-10-20(17-25(24)34-2)23-19-31(21-7-4-3-5-8-21)28-26(23)27(32)30-14-12-29(13-15-30)18-22-9-6-16-35-22/h3-11,16-17,19H,12-15,18H2,1-2H3