tert-butyl N-[1-[2-[(3-azanyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)-methyl-carbamoyl]-3-phenyl-phenyl]-2-methyl-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[2-[(3-azanyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)-methyl-carbamoyl]-3-phenyl-phenyl]-2-methyl-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-[2-[(3-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)-methyl-carbamoyl]-3-phenyl-phenyl]-1,1-dimethyl-2-oxo-ethyl]carbamate CAS Name: N-[1-[2-[[(3-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)-methylamino]-oxomethyl]-3-phenylphenyl]-2-methyl-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[2-[(3-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)-methylcarbamoyl]-3-phenylphenyl]-2-methyl-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[2-[(3-amino-2-keto-4,5-dihydro-3H-1-benzazepin-1-yl)-methyl-carbamoyl]-3-phenyl-phenyl]-2-keto-1,1-dimethyl-ethyl]carbamic acid tert-butyl ester Formula: C33H38N4O5 MolecularWeight: 570.67862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C)(C)C(=O)C1=CC=CC(=C1C(=O)N(C)N2C3=CC=CC=C3CCC(C2=O)N)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NC(C)(C)C(=O)C1=CC=CC(=C1C(=O)N(C)N2C3=CC=CC=C3CCC(C2=O)N)C4=CC=CC=C4

InChI

InChI=1S/C33H38N4O5/c1-32(2,3)42-31(41)35-33(4,5)28(38)24-17-12-16-23(21-13-8-7-9-14-21)27(24)30(40)36(6)37-26-18-11-10-15-22(26)19-20-25(34)29(37)39/h7-18,25H,19-20,34H2,1-6H3,(H,35,41)