(2-azanyl-4H-3,1-benzoxazin-6-yl) N-tert-butyl-N-[3-(2-methyl-3-oxidanylidene-pyrrolidin-1-yl)-3-oxidanylidene-2-pyridin-3-yl-propyl]carbamate

Systemtic Name: (2-azanyl-4H-3,1-benzoxazin-6-yl) N-tert-butyl-N-[3-(2-methyl-3-oxidanylidene-pyrrolidin-1-yl)-3-oxidanylidene-2-pyridin-3-yl-propyl]carbamate Openeye Name: (2-amino-4H-3,1-benzoxazin-6-yl) N-tert-butyl-N-[3-(2-methyl-3-oxo-pyrrolidin-1-yl)-3-oxo-2-(3-pyridyl)propyl]carbamate CAS Name: N-tert-butyl-N-[3-(2-methyl-3-oxo-1-pyrrolidinyl)-3-oxo-2-(3-pyridinyl)propyl]carbamic acid (2-amino-4H-3,1-benzoxazin-6-yl) ester IUPAC Name: (2-amino-4H-3,1-benzoxazin-6-yl) N-tert-butyl-N-[3-(2-methyl-3-oxopyrrolidin-1-yl)-3-oxo-2-pyridin-3-ylpropyl]carbamate Traditional Name: N-tert-butyl-N-[3-keto-3-(3-keto-2-methyl-pyrrolidino)-2-(3-pyridyl)propyl]carbamic acid (2-amino-4H-3,1-benzoxazin-6-yl) ester Formula: C26H31N5O5 MolecularWeight: 493.55484

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)CCN1C(=O)C(CN(C(=O)OC2=CC3=C(C=C2)N=C(OC3)N)C(C)(C)C)C4=CN=CC=C4

Isomeric SMILES

CC1C(=O)CCN1C(=O)C(CN(C(=O)OC2=CC3=C(C=C2)N=C(OC3)N)C(C)(C)C)C4=CN=CC=C4

InChI

InChI=1S/C26H31N5O5/c1-16-22(32)9-11-30(16)23(33)20(17-6-5-10-28-13-17)14-31(26(2,3)4)25(34)36-19-7-8-21-18(12-19)15-35-24(27)29-21/h5-8,10,12-13,16,20H,9,11,14-15H2,1-4H3,(H2,27,29)