(2-azanyl-4-oxidanylidene-3,1-benzoxazin-6-yl) N-tert-butyl-N-[1-[(2,5-dimethylphenyl)methylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: (2-azanyl-4-oxidanylidene-3,1-benzoxazin-6-yl) N-tert-butyl-N-[1-[(2,5-dimethylphenyl)methylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: (2-amino-4-oxo-3,1-benzoxazin-6-yl) N-[1-benzyl-2-[(2,5-dimethylphenyl)methylamino]-2-oxo-ethyl]-N-tert-butyl-carbamate CAS Name: N-tert-butyl-N-[1-[(2,5-dimethylphenyl)methylamino]-1-oxo-3-phenylpropan-2-yl]carbamic acid (2-amino-4-oxo-3,1-benzoxazin-6-yl) ester IUPAC Name: (2-amino-4-oxo-3,1-benzoxazin-6-yl) N-tert-butyl-N-[1-[(2,5-dimethylphenyl)methylamino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-[(2,5-dimethylbenzyl)amino]-2-keto-ethyl]-N-tert-butyl-carbamic acid (2-amino-4-keto-3,1-benzoxazin-6-yl) ester Formula: C31H34N4O5 MolecularWeight: 542.62546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CNC(=O)C(CC2=CC=CC=C2)N(C(=O)OC3=CC4=C(C=C3)N=C(OC4=O)N)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CNC(=O)C(CC2=CC=CC=C2)N(C(=O)OC3=CC4=C(C=C3)N=C(OC4=O)N)C(C)(C)C

InChI

InChI=1S/C31H34N4O5/c1-19-11-12-20(2)22(15-19)18-33-27(36)26(16-21-9-7-6-8-10-21)35(31(3,4)5)30(38)39-23-13-14-25-24(17-23)28(37)40-29(32)34-25/h6-15,17,26H,16,18H2,1-5H3,(H2,32,34)(H,33,36)