methyl 2-[2-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]-1-oxidanylidene-isoquinolin-5-yl]oxyethanoate

Systemtic Name: methyl 2-[2-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]-1-oxidanylidene-isoquinolin-5-yl]oxyethanoate Openeye Name: methyl 2-[[2-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]-1-oxo-5-isoquinolyl]oxy]acetate CAS Name: 2-[[2-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]-1-oxo-5-isoquinolinyl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxyacetate Traditional Name: 2-[[1-keto-2-[2-keto-2-[(6-methyl-1,3-benzothiazol-2-yl)amino]ethyl]-5-isoquinolyl]oxy]acetic acid methyl ester Formula: C22H19N3O5S MolecularWeight: 437.46836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C=CC4=C(C3=O)C=CC=C4OCC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C=CC4=C(C3=O)C=CC=C4OCC(=O)OC

InChI

InChI=1S/C22H19N3O5S/c1-13-6-7-16-18(10-13)31-22(23-16)24-19(26)11-25-9-8-14-15(21(25)28)4-3-5-17(14)30-12-20(27)29-2/h3-10H,11-12H2,1-2H3,(H,23,24,26)