2-diethylaminoethyl 3-[6-(7-chloranyl-4-oxidanylidene-1,3-benzothiazin-2-yl)-4-methylsulfonyl-pyridin-2-yl]propanoate

Systemtic Name: 2-diethylaminoethyl 3-[6-(7-chloranyl-4-oxidanylidene-1,3-benzothiazin-2-yl)-4-methylsulfonyl-pyridin-2-yl]propanoate Openeye Name: 2-diethylaminoethyl 3-[6-(7-chloro-4-oxo-1,3-benzothiazin-2-yl)-4-methylsulfonyl-2-pyridyl]propanoate CAS Name: 3-[6-(7-chloro-4-oxo-1,3-benzothiazin-2-yl)-4-methylsulfonyl-2-pyridinyl]propanoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 3-[6-(7-chloro-4-oxo-1,3-benzothiazin-2-yl)-4-methylsulfonylpyridin-2-yl]propanoate Traditional Name: 3-[6-(7-chloro-4-keto-1,3-benzothiazin-2-yl)-4-mesyl-2-pyridyl]propionic acid 2-diethylaminoethyl ester Formula: C23H26ClN3O5S2 MolecularWeight: 524.05264

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)CCC1=CC(=CC(=N1)C2=NC(=O)C3=C(S2)C=C(C=C3)Cl)S(=O)(=O)C

Isomeric SMILES

CCN(CC)CCOC(=O)CCC1=CC(=CC(=N1)C2=NC(=O)C3=C(S2)C=C(C=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C23H26ClN3O5S2/c1-4-27(5-2)10-11-32-21(28)9-7-16-13-17(34(3,30)31)14-19(25-16)23-26-22(29)18-8-6-15(24)12-20(18)33-23/h6,8,12-14H,4-5,7,9-11H2,1-3H3