2-azanyl-N-[[3-[[(3R)-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamoylamino]phenyl]methyl]ethanamide

Systemtic Name: 2-azanyl-N-[[3-[[(3R)-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamoylamino]phenyl]methyl]ethanamide Openeye Name: 2-amino-N-[[3-[[(3R)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamoylamino]phenyl]methyl]acetamide CAS Name: 2-amino-N-[[3-[[[[(3R)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]amino]-oxomethyl]amino]phenyl]methyl]acetamide IUPAC Name: 2-amino-N-[[3-[[(3R)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamoylamino]phenyl]methyl]acetamide Traditional Name: 2-amino-N-[3-[[(3R)-2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl]carbamoylamino]benzyl]acetamide Formula: C26H26N6O3 MolecularWeight: 470.52304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CN1C2=CC=CC=C2C(=N[C@H](C1=O)NC(=O)NC3=CC=CC(=C3)CNC(=O)CN)C4=CC=CC=C4

InChI

InChI=1S/C26H26N6O3/c1-32-21-13-6-5-12-20(21)23(18-9-3-2-4-10-18)30-24(25(32)34)31-26(35)29-19-11-7-8-17(14-19)16-28-22(33)15-27/h2-14,24H,15-16,27H2,1H3,(H,28,33)(H2,29,31,35)/t24-/m0/s1