(2-azanyl-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl) N-(4-azanyl-3-methylsulfonyl-4-oxidanylidene-butyl)-N-(1-piperidin-1-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-piperidin-1-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-(1-piperidyl)ethyl]carbamate CAS Name: N-(4-amino-3-methylsulfonyl-4-oxobutyl)-N-[1-(1-piperidinyl)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-piperidin-1-ylpropan-2-yl)carbamate Traditional Name: N-(4-amino-4-keto-3-mesyl-butyl)-N-(1-methyl-2-piperidino-ethyl)carbamic acid (2-amino-4-keto-5-methyl-3,1-benzoxazin-6-yl) ester Formula: C23H33N5O7S MolecularWeight: 523.60242

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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)CN3CCCCC3

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)N)OC(=O)N(CCC(C(=O)N)S(=O)(=O)C)C(C)CN3CCCCC3

InChI

InChI=1S/C23H33N5O7S/c1-14(13-27-10-5-4-6-11-27)28(12-9-18(20(24)29)36(3,32)33)23(31)34-17-8-7-16-19(15(17)2)21(30)35-22(25)26-16/h7-8,14,18H,4-6,9-13H2,1-3H3,(H2,24,29)(H2,25,26)