4-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-butanamide

Systemtic Name: 4-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-butanamide Openeye Name: 4-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-butanamide CAS Name: 4-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide IUPAC Name: 4-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxobutanamide Traditional Name: 4-keto-4-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)butyramide Formula: C18H22N6O6S2 MolecularWeight: 482.53388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)NC3=NN=C(S3)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)NC3=NN=C(S3)C

InChI

InChI=1S/C18H22N6O6S2/c1-12-3-4-14(24(27)28)11-15(12)32(29,30)23-9-7-22(8-10-23)17(26)6-5-16(25)19-18-21-20-13(2)31-18/h3-4,11H,5-10H2,1-2H3,(H,19,21,25)