(3-nitro-4-piperidin-1-yl-phenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (3-nitro-4-piperidin-1-yl-phenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: [3-nitro-4-(1-piperidyl)phenyl]-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: [3-nitro-4-(1-piperidinyl)phenyl]-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (3-nitro-4-piperidin-1-ylphenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (3-nitro-4-piperidino-phenyl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C20H24N4O5S2 MolecularWeight: 464.55836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O5S2/c25-20(22-10-12-23(13-11-22)31(28,29)19-5-4-14-30-19)16-6-7-17(18(15-16)24(26)27)21-8-2-1-3-9-21/h4-7,14-15H,1-3,8-13H2