methyl 2-[3-[(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)carbamoylamino]phenyl]ethanoate

Systemtic Name: methyl 2-[3-[(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)carbamoylamino]phenyl]ethanoate Openeye Name: methyl 2-[3-[(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)carbamoylamino]phenyl]acetate CAS Name: 2-[3-[[[(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)amino]-oxomethyl]amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)carbamoylamino]phenyl]acetate Traditional Name: 2-[3-[(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)carbamoylamino]phenyl]acetic acid methyl ester Formula: C26H24N4O4 MolecularWeight: 456.49316

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)NC3=CC=CC(=C3)CC(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)NC3=CC=CC(=C3)CC(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C26H24N4O4/c1-30-21-14-7-6-13-20(21)23(18-10-4-3-5-11-18)28-24(25(30)32)29-26(33)27-19-12-8-9-17(15-19)16-22(31)34-2/h3-15,24H,16H2,1-2H3,(H2,27,29,33)