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

Systemtic Name: (3-methyl-2-nitro-phenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (3-methyl-2-nitro-phenyl)-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: (3-methyl-2-nitrophenyl)-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (3-methyl-2-nitrophenyl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (3-methyl-2-nitro-phenyl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C16H17N3O5S2 MolecularWeight: 395.45328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

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