1-(3-cyanophenyl)-1-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea

Systemtic Name: 1-(3-cyanophenyl)-1-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea Openeye Name: 1-(3-cyanophenyl)-1-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea CAS Name: 1-(3-cyanophenyl)-1-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea IUPAC Name: 1-(3-cyanophenyl)-1-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea Traditional Name: 1-(3-cyanophenyl)-1-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea Formula: C24H19N5O2 MolecularWeight: 409.43996

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)N(C3=CC=CC(=C3)C#N)C(=O)N)C4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)N(C3=CC=CC(=C3)C#N)C(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C24H19N5O2/c1-28-20-13-6-5-12-19(20)21(17-9-3-2-4-10-17)27-22(23(28)30)29(24(26)31)18-11-7-8-16(14-18)15-25/h2-14,22H,1H3,(H2,26,31)