ethyl 2-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylethanoylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylethanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[[2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]acetyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[1-oxo-2-[(4,6,8-trimethyl-2-quinolinyl)thio]ethyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4,6,8-trimethylquinolin-2-yl)sulfanylacetyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[2-[(4,6,8-trimethyl-2-quinolyl)thio]acetyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C24H23N3O3S2 MolecularWeight: 465.58772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC4=C(C=C(C=C4C(=C3)C)C)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC4=C(C=C(C=C4C(=C3)C)C)C

InChI

InChI=1S/C24H23N3O3S2/c1-5-30-23(29)16-6-7-18-19(11-16)32-24(25-18)26-20(28)12-31-21-10-14(3)17-9-13(2)8-15(4)22(17)27-21/h6-11H,5,12H2,1-4H3,(H,25,26,28)