(4-ethyl-5-propyl-thiophen-2-yl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (4-ethyl-5-propyl-thiophen-2-yl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-ethyl-5-propyl-2-thienyl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (4-ethyl-5-propyl-2-thiophenyl)-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-ethyl-5-propylthiophen-2-yl)-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (4-ethyl-5-propyl-2-thienyl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]methanone Formula: C21H27N3O6S2 MolecularWeight: 481.58558

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(S1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])CC

Isomeric SMILES

CCCC1=C(C=C(S1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])CC

InChI

InChI=1S/C21H27N3O6S2/c1-4-6-19-15(5-2)13-20(31-19)21(25)22-9-11-23(12-10-22)32(28,29)16-7-8-18(30-3)17(14-16)24(26)27/h7-8,13-14H,4-6,9-12H2,1-3H3