methyl 5-methylsulfanyl-4-[2-(quinolin-3-ylamino)-1,3-thiazol-4-yl]thiophene-2-carboxylate hydrobromide

Systemtic Name: methyl 5-methylsulfanyl-4-[2-(quinolin-3-ylamino)-1,3-thiazol-4-yl]thiophene-2-carboxylate hydrobromide Openeye Name: methyl 5-methylsulfanyl-4-[2-(3-quinolylamino)thiazol-4-yl]thiophene-2-carboxylate hydrobromide CAS Name: 5-(methylthio)-4-[2-(3-quinolinylamino)-4-thiazolyl]-2-thiophenecarboxylic acid methyl ester hydrobromide IUPAC Name: methyl 5-methylsulfanyl-4-[2-(quinolin-3-ylamino)-1,3-thiazol-4-yl]thiophene-2-carboxylate hydrobromide Traditional Name: 5-(methylthio)-4-[2-(3-quinolylamino)thiazol-4-yl]thiophene-2-carboxylic acid methyl ester hydrobromide Formula: C19H16BrN3O2S3 MolecularWeight: 494.44824

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)SC)C2=CSC(=N2)NC3=CC4=CC=CC=C4N=C3.Br

Isomeric SMILES

COC(=O)C1=CC(=C(S1)SC)C2=CSC(=N2)NC3=CC4=CC=CC=C4N=C3.Br

InChI

InChI=1S/C19H15N3O2S3.BrH/c1-24-17(23)16-8-13(18(25-2)27-16)15-10-26-19(22-15)21-12-7-11-5-3-4-6-14(11)20-9-12;/h3-10H,1-2H3,(H,21,22);1H