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

Systemtic Name: methyl 5-methylsulfanyl-4-[2-(naphthalen-2-ylamino)-1,3-thiazol-4-yl]thiophene-2-carboxylate hydrobromide Openeye Name: methyl 5-methylsulfanyl-4-[2-(2-naphthylamino)thiazol-4-yl]thiophene-2-carboxylate hydrobromide CAS Name: 5-(methylthio)-4-[2-(2-naphthalenylamino)-4-thiazolyl]-2-thiophenecarboxylic acid methyl ester hydrobromide IUPAC Name: methyl 5-methylsulfanyl-4-[2-(naphthalen-2-ylamino)-1,3-thiazol-4-yl]thiophene-2-carboxylate hydrobromide Traditional Name: 5-(methylthio)-4-[2-(2-naphthylamino)thiazol-4-yl]thiophene-2-carboxylic acid methyl ester hydrobromide Formula: C20H17BrN2O2S3 MolecularWeight: 493.46018

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)SC)C2=CSC(=N2)NC3=CC4=CC=CC=C4C=C3.Br

Isomeric SMILES

COC(=O)C1=CC(=C(S1)SC)C2=CSC(=N2)NC3=CC4=CC=CC=C4C=C3.Br

InChI

InChI=1S/C20H16N2O2S3.BrH/c1-24-18(23)17-10-15(19(25-2)27-17)16-11-26-20(22-16)21-14-8-7-12-5-3-4-6-13(12)9-14;/h3-11H,1-2H3,(H,21,22);1H