methyl 2-[3-(2-bromophenyl)sulfanylpropanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[3-(2-bromophenyl)sulfanylpropanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[3-(2-bromophenyl)sulfanylpropanoylamino]thiazole-5-carboxylate CAS Name: 2-[[3-[(2-bromophenyl)thio]-1-oxopropyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(2-bromophenyl)sulfanylpropanoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-[(2-bromophenyl)thio]propanoylamino]thiazole-5-carboxylic acid methyl ester Formula: C14H13BrN2O3S2 MolecularWeight: 401.29862

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(S1)NC(=O)CCSC2=CC=CC=C2Br

Isomeric SMILES

COC(=O)C1=CN=C(S1)NC(=O)CCSC2=CC=CC=C2Br

InChI

InChI=1S/C14H13BrN2O3S2/c1-20-13(19)11-8-16-14(22-11)17-12(18)6-7-21-10-5-3-2-4-9(10)15/h2-5,8H,6-7H2,1H3,(H,16,17,18)