methyl 4-[2-[(6-methylsulfanyl-1,3-benzothiazol-2-yl)amino]-1,3-thiazol-4-yl]benzoate

Systemtic Name: methyl 4-[2-[(6-methylsulfanyl-1,3-benzothiazol-2-yl)amino]-1,3-thiazol-4-yl]benzoate Openeye Name: methyl 4-[2-[(6-methylsulfanyl-1,3-benzothiazol-2-yl)amino]thiazol-4-yl]benzoate CAS Name: 4-[2-[[6-(methylthio)-1,3-benzothiazol-2-yl]amino]-4-thiazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(6-methylsulfanyl-1,3-benzothiazol-2-yl)amino]-1,3-thiazol-4-yl]benzoate Traditional Name: 4-[2-[[6-(methylthio)-1,3-benzothiazol-2-yl]amino]thiazol-4-yl]benzoic acid methyl ester Formula: C19H15N3O2S3 MolecularWeight: 413.5363

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CSC(=N2)NC3=NC4=C(S3)C=C(C=C4)SC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CSC(=N2)NC3=NC4=C(S3)C=C(C=C4)SC

InChI

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