[1-(4-nitrophenyl)pyrazol-4-yl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [1-(4-nitrophenyl)pyrazol-4-yl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: [1-(4-nitrophenyl)pyrazol-4-yl]-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: [1-(4-nitrophenyl)-4-pyrazolyl]-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: [1-(4-nitrophenyl)pyrazol-4-yl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: [1-(4-nitrophenyl)pyrazol-4-yl]-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C18H17N5O5S2 MolecularWeight: 447.48808

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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=CS4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H17N5O5S2/c24-18(14-12-19-22(13-14)15-3-5-16(6-4-15)23(25)26)20-7-9-21(10-8-20)30(27,28)17-2-1-11-29-17/h1-6,11-13H,7-10H2