[4-(2-methylphenyl)piperazin-1-yl]-[2-(3-nitrophenyl)-5-thiophen-2-yl-pyrazol-3-yl]methanone

Systemtic Name: [4-(2-methylphenyl)piperazin-1-yl]-[2-(3-nitrophenyl)-5-thiophen-2-yl-pyrazol-3-yl]methanone Openeye Name: [2-(3-nitrophenyl)-5-(2-thienyl)pyrazol-3-yl]-[4-(o-tolyl)piperazin-1-yl]methanone CAS Name: [4-(2-methylphenyl)-1-piperazinyl]-[2-(3-nitrophenyl)-5-thiophen-2-yl-3-pyrazolyl]methanone IUPAC Name: [4-(2-methylphenyl)piperazin-1-yl]-[2-(3-nitrophenyl)-5-thiophen-2-ylpyrazol-3-yl]methanone Traditional Name: [2-(3-nitrophenyl)-5-(2-thienyl)pyrazol-3-yl]-[4-(o-tolyl)piperazino]methanone Formula: C25H23N5O3S MolecularWeight: 473.54682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=NN3C4=CC(=CC=C4)[N+](=O)[O-])C5=CC=CS5

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=NN3C4=CC(=CC=C4)[N+](=O)[O-])C5=CC=CS5

InChI

InChI=1S/C25H23N5O3S/c1-18-6-2-3-9-22(18)27-11-13-28(14-12-27)25(31)23-17-21(24-10-5-15-34-24)26-29(23)19-7-4-8-20(16-19)30(32)33/h2-10,15-17H,11-14H2,1H3