[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone

Systemtic Name: [4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone Openeye Name: [4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone CAS Name: [4-(3-chlorophenyl)sulfonyl-1-piperazinyl]-[1-(4-nitrophenyl)-4-pyrazolyl]methanone IUPAC Name: [4-(3-chlorophenyl)sulfonylpiperazin-1-yl]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone Traditional Name: [4-(3-chlorophenyl)sulfonylpiperazino]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone Formula: C20H18ClN5O5S MolecularWeight: 475.90542

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H18ClN5O5S/c21-16-2-1-3-19(12-16)32(30,31)24-10-8-23(9-11-24)20(27)15-13-22-25(14-15)17-4-6-18(7-5-17)26(28)29/h1-7,12-14H,8-11H2