[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-(2-thiophen-2-yl-1,3-thiazol-4-yl)methanone

Systemtic Name: [4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-(2-thiophen-2-yl-1,3-thiazol-4-yl)methanone Openeye Name: [4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-[2-(2-thienyl)thiazol-4-yl]methanone CAS Name: [4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]-(2-thiophen-2-yl-4-thiazolyl)methanone IUPAC Name: [4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]-(2-thiophen-2-yl-1,3-thiazol-4-yl)methanone Traditional Name: [4-(4-mesyl-2-nitro-phenyl)piperazino]-[2-(2-thienyl)thiazol-4-yl]methanone Formula: C19H18N4O5S3 MolecularWeight: 478.56502

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CSC(=N3)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CSC(=N3)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O5S3/c1-31(27,28)13-4-5-15(16(11-13)23(25)26)21-6-8-22(9-7-21)19(24)14-12-30-18(20-14)17-3-2-10-29-17/h2-5,10-12H,6-9H2,1H3