methyl 4-[(2-azanyl-4-methyl-1,3-thiazol-5-yl)sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[(2-azanyl-4-methyl-1,3-thiazol-5-yl)sulfanylmethyl]benzoate Openeye Name: methyl 4-[(2-amino-4-methyl-thiazol-5-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(2-amino-4-methyl-5-thiazolyl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-amino-4-methyl-1,3-thiazol-5-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(2-amino-4-methyl-thiazol-5-yl)thio]methyl]benzoic acid methyl ester Formula: C13H14N2O2S2 MolecularWeight: 294.39246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N)SCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)N)SCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C13H14N2O2S2/c1-8-12(19-13(14)15-8)18-7-9-3-5-10(6-4-9)11(16)17-2/h3-6H,7H2,1-2H3,(H2,14,15)