tert-butyl N-[1-oxidanylidene-3-phenyl-1-[(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)amino]propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-oxidanylidene-3-phenyl-1-[(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)amino]propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-benzyl-2-oxo-2-[(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)amino]ethyl]carbamate CAS Name: N-[1-oxo-3-phenyl-1-[(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)amino]propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-oxo-3-phenyl-1-[(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)amino]propan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-keto-2-[(6-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepin-4-yl)amino]ethyl]carbamic acid tert-butyl ester Formula: C32H32N4O3 MolecularWeight: 520.62148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC2C3=CC=CN3C4=CC=CC=C4C(=N2)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC2C3=CC=CN3C4=CC=CC=C4C(=N2)C5=CC=CC=C5

InChI

InChI=1S/C32H32N4O3/c1-32(2,3)39-31(38)33-25(21-22-13-6-4-7-14-22)30(37)35-29-27-19-12-20-36(27)26-18-11-10-17-24(26)28(34-29)23-15-8-5-9-16-23/h4-20,25,29H,21H2,1-3H3,(H,33,38)(H,35,37)