1-[[2-methyl-3-[(6-methylpyridin-2-yl)carbamoyl]-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-4-yl]oxy]ethyl propanoate

Systemtic Name: 1-[[2-methyl-3-[(6-methylpyridin-2-yl)carbamoyl]-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-4-yl]oxy]ethyl propanoate Openeye Name: 1-[[2-methyl-3-[(6-methyl-2-pyridyl)carbamoyl]-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl]oxy]ethyl propanoate CAS Name: propanoic acid 1-[[2-methyl-3-[[(6-methyl-2-pyridinyl)amino]-oxomethyl]-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl]oxy]ethyl ester IUPAC Name: 1-[[2-methyl-3-[(6-methylpyridin-2-yl)carbamoyl]-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl]oxy]ethyl propanoate Traditional Name: propionic acid 1-[[1,1-diketo-2-methyl-3-[(6-methyl-2-pyridyl)carbamoyl]-1$l^{6},2-benzothiazin-4-yl]oxy]ethyl ester Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(C)OC1=C(N(S(=O)(=O)C2=CC=CC=C21)C)C(=O)NC3=CC=CC(=N3)C

Isomeric SMILES

CCC(=O)OC(C)OC1=C(N(S(=O)(=O)C2=CC=CC=C21)C)C(=O)NC3=CC=CC(=N3)C

InChI

InChI=1S/C21H23N3O6S/c1-5-18(25)29-14(3)30-20-15-10-6-7-11-16(15)31(27,28)24(4)19(20)21(26)23-17-12-8-9-13(2)22-17/h6-12,14H,5H2,1-4H3,(H,22,23,26)