1-(1-methyl-2-oxidanylidene-1,5-diphenyl-3H-1,4-benzodiazepin-1-ium-3-yl)urea

Systemtic Name: 1-(1-methyl-2-oxidanylidene-1,5-diphenyl-3H-1,4-benzodiazepin-1-ium-3-yl)urea Openeye Name: (1-methyl-2-oxo-1,5-diphenyl-3H-1,4-benzodiazepin-1-ium-3-yl)urea CAS Name: (1-methyl-2-oxo-1,5-diphenyl-3H-1,4-benzodiazepin-1-ium-3-yl)urea IUPAC Name: (1-methyl-2-oxo-1,5-diphenyl-3H-1,4-benzodiazepin-1-ium-3-yl)urea Traditional Name: (2-keto-1-methyl-1,5-diphenyl-3H-1,4-benzodiazepin-1-ium-3-yl)urea Formula: C23H21N4O2+ MolecularWeight: 385.43844

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2=CC=CC=C2C(=NC(C1=O)NC(=O)N)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[N+]1(C2=CC=CC=C2C(=NC(C1=O)NC(=O)N)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H20N4O2/c1-27(17-12-6-3-7-13-17)19-15-9-8-14-18(19)20(16-10-4-2-5-11-16)25-21(22(27)28)26-23(24)29/h2-15,21H,1H3,(H2-,24,26,29)/p+1