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

Systemtic Name: [2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl 5-azanyl-3-methyl-1,2-thiazole-4-carboxylate Openeye Name: [2-(3-bromophenyl)thiazol-4-yl]methyl 5-amino-3-methyl-isothiazole-4-carboxylate CAS Name: 5-amino-3-methyl-4-isothiazolecarboxylic acid [2-(3-bromophenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3-bromophenyl)-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-(3-bromophenyl)thiazol-4-yl]methyl ester Formula: C15H12BrN3O2S2 MolecularWeight: 410.30868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OCC2=CSC(=N2)C3=CC(=CC=C3)Br)N

Isomeric SMILES

CC1=NSC(=C1C(=O)OCC2=CSC(=N2)C3=CC(=CC=C3)Br)N

InChI

InChI=1S/C15H12BrN3O2S2/c1-8-12(13(17)23-19-8)15(20)21-6-11-7-22-14(18-11)9-3-2-4-10(16)5-9/h2-5,7H,6,17H2,1H3