methyl 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]thiazole-5-carboxylate CAS Name: 2-[[3-[(4-chlorophenyl)thio]-1-oxopropyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-[(4-chlorophenyl)thio]propanoylamino]thiazole-5-carboxylic acid methyl ester Formula: C14H13ClN2O3S2 MolecularWeight: 356.84762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(S1)NC(=O)CCSC2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)C1=CN=C(S1)NC(=O)CCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H13ClN2O3S2/c1-20-13(19)11-8-16-14(22-11)17-12(18)6-7-21-10-4-2-9(15)3-5-10/h2-5,8H,6-7H2,1H3,(H,16,17,18)