(2-azanyl-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl) N-(4-azanyl-3-methylsulfonyl-4-oxidanylidene-butyl)-N-(1-morpholin-4-ylpropan-2-yl)carbamate

Systemtic Name: (2-azanyl-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl) N-(4-azanyl-3-methylsulfonyl-4-oxidanylidene-butyl)-N-(1-morpholin-4-ylpropan-2-yl)carbamate Openeye Name: (2-amino-5-methyl-4-oxo-3,1-benzoxazin-6-yl) N-(4-amino-3-methylsulfonyl-4-oxo-butyl)-N-(1-methyl-2-morpholino-ethyl)carbamate CAS Name: N-(4-amino-3-methylsulfonyl-4-oxobutyl)-N-[1-(4-morpholinyl)propan-2-yl]carbamic acid (2-amino-5-methyl-4-oxo-3,1-benzoxazin-6-yl) ester IUPAC Name: (2-amino-5-methyl-4-oxo-3,1-benzoxazin-6-yl) N-(4-amino-3-methylsulfonyl-4-oxobutyl)-N-(1-morpholin-4-ylpropan-2-yl)carbamate Traditional Name: N-(4-amino-4-keto-3-mesyl-butyl)-N-(1-methyl-2-morpholino-ethyl)carbamic acid (2-amino-4-keto-5-methyl-3,1-benzoxazin-6-yl) ester Formula: C22H31N5O8S MolecularWeight: 525.57524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)N)OC(=O)N(CCC(C(=O)N)S(=O)(=O)C)C(C)CN3CCOCC3

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)N)OC(=O)N(CCC(C(=O)N)S(=O)(=O)C)C(C)CN3CCOCC3

InChI

InChI=1S/C22H31N5O8S/c1-13(12-26-8-10-33-11-9-26)27(7-6-17(19(23)28)36(3,31)32)22(30)34-16-5-4-15-18(14(16)2)20(29)35-21(24)25-15/h4-5,13,17H,6-12H2,1-3H3,(H2,23,28)(H2,24,25)