[[azanyl(benzimidazol-2-ylidene)methyl]amino] 2-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-3-oxidanylidene-2,5-dihydro-1H-1,4-benzodiazepine-7-carboxylate

Systemtic Name: [[azanyl(benzimidazol-2-ylidene)methyl]amino] 2-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-3-oxidanylidene-2,5-dihydro-1H-1,4-benzodiazepine-7-carboxylate Openeye Name: [[amino(benzimidazol-2-ylidene)methyl]amino] 2-(2-methoxy-2-oxo-ethyl)-4-methyl-3-oxo-2,5-dihydro-1H-1,4-benzodiazepine-7-carboxylate CAS Name: 2-(2-methoxy-2-oxoethyl)-4-methyl-3-oxo-2,5-dihydro-1H-1,4-benzodiazepine-7-carboxylic acid [[amino(2-benzimidazolylidene)methyl]amino] ester IUPAC Name: [[amino(benzimidazol-2-ylidene)methyl]amino] 2-(2-methoxy-2-oxoethyl)-4-methyl-3-oxo-2,5-dihydro-1H-1,4-benzodiazepine-7-carboxylate Traditional Name: 3-keto-2-(2-keto-2-methoxy-ethyl)-4-methyl-2,5-dihydro-1H-1,4-benzodiazepine-7-carboxylic acid [[amino(benzimidazol-2-ylidene)methyl]amino] ester Formula: C22H22N6O5 MolecularWeight: 450.44728

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(C=CC(=C2)C(=O)ONC(=C3N=C4C=CC=CC4=N3)N)NC(C1=O)CC(=O)OC

Isomeric SMILES

CN1CC2=C(C=CC(=C2)C(=O)ONC(=C3N=C4C=CC=CC4=N3)N)NC(C1=O)CC(=O)OC

InChI

InChI=1S/C22H22N6O5/c1-28-11-13-9-12(7-8-14(13)24-17(21(28)30)10-18(29)32-2)22(31)33-27-19(23)20-25-15-5-3-4-6-16(15)26-20/h3-9,17,24,27H,10-11,23H2,1-2H3