tert-butyl N-[(1S)-1-[(2R)-4-methyl-5-oxidanylidene-2,3-dihydro-1H-1,4-benzodiazepin-2-yl]-2-phenyl-ethyl]carbamate

Systemtic Name: tert-butyl N-[(1S)-1-[(2R)-4-methyl-5-oxidanylidene-2,3-dihydro-1H-1,4-benzodiazepin-2-yl]-2-phenyl-ethyl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(2R)-4-methyl-5-oxo-2,3-dihydro-1H-1,4-benzodiazepin-2-yl]-2-phenyl-ethyl]carbamate CAS Name: N-[(1S)-1-[(2R)-4-methyl-5-oxo-2,3-dihydro-1H-1,4-benzodiazepin-2-yl]-2-phenylethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1S)-1-[(2R)-4-methyl-5-oxo-2,3-dihydro-1H-1,4-benzodiazepin-2-yl]-2-phenylethyl]carbamate Traditional Name: N-[(1S)-1-[(2R)-5-keto-4-methyl-2,3-dihydro-1H-1,4-benzodiazepin-2-yl]-2-phenyl-ethyl]carbamic acid tert-butyl ester Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C2CN(C(=O)C3=CC=CC=C3N2)C

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@H]2CN(C(=O)C3=CC=CC=C3N2)C

InChI

InChI=1S/C23H29N3O3/c1-23(2,3)29-22(28)25-19(14-16-10-6-5-7-11-16)20-15-26(4)21(27)17-12-8-9-13-18(17)24-20/h5-13,19-20,24H,14-15H2,1-4H3,(H,25,28)/t19-,20+/m0/s1