[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-(3-phenylthiophen-2-yl)methanone

Systemtic Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-(3-phenylthiophen-2-yl)methanone Openeye Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-(3-phenyl-2-thienyl)methanone CAS Name: [4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]-(3-phenyl-2-thiophenyl)methanone IUPAC Name: [4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]-(3-phenylthiophen-2-yl)methanone Traditional Name: [4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]-(3-phenyl-2-thienyl)methanone Formula: C22H21N3O6S2 MolecularWeight: 487.54864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CS3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CS3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O6S2/c1-31-20-8-7-17(15-19(20)25(27)28)33(29,30)24-12-10-23(11-13-24)22(26)21-18(9-14-32-21)16-5-3-2-4-6-16/h2-9,14-15H,10-13H2,1H3