(2-azanyl-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl) N-(2-dimethylaminoethyl)-N-[4-(methylamino)-3-methylsulfonyl-4-oxidanylidene-butyl]carbamate

Systemtic Name: (2-azanyl-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl) N-(2-dimethylaminoethyl)-N-[4-(methylamino)-3-methylsulfonyl-4-oxidanylidene-butyl]carbamate Openeye Name: (2-amino-5-methyl-4-oxo-3,1-benzoxazin-6-yl) N-(2-dimethylaminoethyl)-N-[4-(methylamino)-3-methylsulfonyl-4-oxo-butyl]carbamate CAS Name: N-(2-dimethylaminoethyl)-N-[4-(methylamino)-3-methylsulfonyl-4-oxobutyl]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-(2-dimethylaminoethyl)-N-[4-(methylamino)-3-methylsulfonyl-4-oxobutyl]carbamate Traditional Name: N-(2-dimethylaminoethyl)-N-[4-keto-3-mesyl-4-(methylamino)butyl]carbamic acid (2-amino-4-keto-5-methyl-3,1-benzoxazin-6-yl) ester Formula: C20H29N5O7S MolecularWeight: 483.53856

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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)NC)S(=O)(=O)C)CCN(C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H29N5O7S/c1-12-14(7-6-13-16(12)18(27)32-19(21)23-13)31-20(28)25(11-10-24(3)4)9-8-15(17(26)22-2)33(5,29)30/h6-7,15H,8-11H2,1-5H3,(H2,21,23)(H,22,26)