methyl N-[6-[4-[(2,4-dinitrophenyl)carbonylamino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate

Systemtic Name: methyl N-[6-[4-[(2,4-dinitrophenyl)carbonylamino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate Openeye Name: methyl N-[6-[4-[(2,4-dinitrobenzoyl)amino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate CAS Name: N-[6-[[4-[[(2,4-dinitrophenyl)-oxomethyl]amino]phenyl]thio]-1H-benzimidazol-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[6-[4-[(2,4-dinitrobenzoyl)amino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate Traditional Name: N-[6-[[4-[(2,4-dinitrobenzoyl)amino]phenyl]thio]-1H-benzimidazol-2-yl]carbamic acid methyl ester Formula: C22H16N6O7S MolecularWeight: 508.46344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3=CC=C(C=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)NC1=NC2=C(N1)C=C(C=C2)SC3=CC=C(C=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H16N6O7S/c1-35-22(30)26-21-24-17-9-7-15(11-18(17)25-21)36-14-5-2-12(3-6-14)23-20(29)16-8-4-13(27(31)32)10-19(16)28(33)34/h2-11H,1H3,(H,23,29)(H2,24,25,26,30)