[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-(4-mesyl-2-nitro-phenyl)piperazino]-(2-thienyl)methanone Formula: C16H17N3O5S2 MolecularWeight: 395.45328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O5S2/c1-26(23,24)12-4-5-13(14(11-12)19(21)22)17-6-8-18(9-7-17)16(20)15-3-2-10-25-15/h2-5,10-11H,6-9H2,1H3