[2-azanyl-8-[2-bromanyl-1-[(2-ethylphenyl)methylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl] N-tert-butylcarbamate

Systemtic Name: [2-azanyl-8-[2-bromanyl-1-[(2-ethylphenyl)methylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl] N-tert-butylcarbamate Openeye Name: [2-amino-8-[1-benzyl-1-bromo-2-[(2-ethylphenyl)methylamino]-2-oxo-ethyl]-5-methyl-4-oxo-3,1-benzoxazin-6-yl] N-tert-butylcarbamate CAS Name: N-tert-butylcarbamic acid [2-amino-8-[2-bromo-1-[(2-ethylphenyl)methylamino]-1-oxo-3-phenylpropan-2-yl]-5-methyl-4-oxo-3,1-benzoxazin-6-yl] ester IUPAC Name: [2-amino-8-[2-bromo-1-[(2-ethylphenyl)methylamino]-1-oxo-3-phenylpropan-2-yl]-5-methyl-4-oxo-3,1-benzoxazin-6-yl] N-tert-butylcarbamate Traditional Name: N-tert-butylcarbamic acid [2-amino-8-[1-benzyl-1-bromo-2-[(2-ethylbenzyl)amino]-2-keto-ethyl]-4-keto-5-methyl-3,1-benzoxazin-6-yl] ester Formula: C32H35BrN4O5 MolecularWeight: 635.5481

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1CNC(=O)C(CC2=CC=CC=C2)(C3=CC(=C(C4=C3N=C(OC4=O)N)C)OC(=O)NC(C)(C)C)Br

Isomeric SMILES

CCC1=CC=CC=C1CNC(=O)C(CC2=CC=CC=C2)(C3=CC(=C(C4=C3N=C(OC4=O)N)C)OC(=O)NC(C)(C)C)Br

InChI

InChI=1S/C32H35BrN4O5/c1-6-21-14-10-11-15-22(21)18-35-28(39)32(33,17-20-12-8-7-9-13-20)23-16-24(41-30(40)37-31(3,4)5)19(2)25-26(23)36-29(34)42-27(25)38/h7-16H,6,17-18H2,1-5H3,(H2,34,36)(H,35,39)(H,37,40)