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

Systemtic Name: tert-butyl N-[3-[[2-oxidanylidene-3-(phenylcarbamoylamino)-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]carbamate Openeye Name: tert-butyl N-[3-[[2-oxo-3-(phenylcarbamoylamino)-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]carbamate CAS Name: N-[3-[[3-[[anilino(oxo)methyl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[[2-oxo-3-(phenylcarbamoylamino)-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]carbamate Traditional Name: N-[3-[[2-keto-3-(phenylcarbamoylamino)-4,5-dihydro-3H-1-benzazepin-1-yl]methyl]phenyl]carbamic acid tert-butyl ester Formula: C29H32N4O4 MolecularWeight: 500.58878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC(=C1)CN2C3=CC=CC=C3CCC(C2=O)NC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1)CN2C3=CC=CC=C3CCC(C2=O)NC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C29H32N4O4/c1-29(2,3)37-28(36)31-23-14-9-10-20(18-23)19-33-25-15-8-7-11-21(25)16-17-24(26(33)34)32-27(35)30-22-12-5-4-6-13-22/h4-15,18,24H,16-17,19H2,1-3H3,(H,31,36)(H2,30,32,35)