[2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 5-azanyl-3-methyl-1,2-thiazole-4-carboxylate

Systemtic Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 5-azanyl-3-methyl-1,2-thiazole-4-carboxylate Openeye Name: [2-(4-ethylphenyl)thiazol-4-yl]methyl 5-amino-3-methyl-isothiazole-4-carboxylate CAS Name: 5-amino-3-methyl-4-isothiazolecarboxylic acid [2-(4-ethylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-ethylphenyl)-1,3-thiazol-4-yl]methyl 5-amino-3-methyl-1,2-thiazole-4-carboxylate Traditional Name: 5-amino-3-methyl-isothiazole-4-carboxylic acid [2-(4-ethylphenyl)thiazol-4-yl]methyl ester Formula: C17H17N3O2S2 MolecularWeight: 359.46578

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(SN=C3C)N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(SN=C3C)N

InChI

InChI=1S/C17H17N3O2S2/c1-3-11-4-6-12(7-5-11)16-19-13(9-23-16)8-22-17(21)14-10(2)20-24-15(14)18/h4-7,9H,3,8,18H2,1-2H3