N-[4-methylsulfanyl-1-oxidanylidene-1-[[2-oxidanylidene-2-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]amino]butan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[4-methylsulfanyl-1-oxidanylidene-1-[[2-oxidanylidene-2-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]amino]butan-2-yl]-3-nitro-benzamide Openeye Name: N-[3-methylsulfanyl-1-[[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]carbamoyl]propyl]-3-nitro-benzamide CAS Name: N-[4-(methylthio)-1-oxo-1-[[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]amino]butan-2-yl]-3-nitrobenzamide IUPAC Name: N-[4-methylsulfanyl-1-oxo-1-[[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]amino]butan-2-yl]-3-nitrobenzamide Traditional Name: N-[1-[[2-keto-2-[(2-keto-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]carbamoyl]-3-(methylthio)propyl]-3-nitro-benzamide Formula: C21H22N6O6S MolecularWeight: 486.50098

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC(=O)NC1=CC2=C(C=C1)NC(=O)N2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CSCCC(C(=O)NCC(=O)NC1=CC2=C(C=C1)NC(=O)N2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N6O6S/c1-34-8-7-16(24-19(29)12-3-2-4-14(9-12)27(32)33)20(30)22-11-18(28)23-13-5-6-15-17(10-13)26-21(31)25-15/h2-6,9-10,16H,7-8,11H2,1H3,(H,22,30)(H,23,28)(H,24,29)(H2,25,26,31)