methyl 4-[2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]benzoate

Systemtic Name: methyl 4-[2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]benzoate Openeye Name: methyl 4-[2-[3-(4-chlorophenyl)sulfanylpropanoylamino]thiazol-4-yl]benzoate CAS Name: 4-[2-[[3-[(4-chlorophenyl)thio]-1-oxopropyl]amino]-4-thiazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]benzoate Traditional Name: 4-[2-[3-[(4-chlorophenyl)thio]propanoylamino]thiazol-4-yl]benzoic acid methyl ester Formula: C20H17ClN2O3S2 MolecularWeight: 432.94358

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H17ClN2O3S2/c1-26-19(25)14-4-2-13(3-5-14)17-12-28-20(22-17)23-18(24)10-11-27-16-8-6-15(21)7-9-16/h2-9,12H,10-11H2,1H3,(H,22,23,24)