methyl 4-[[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-propanoyl-amino]benzoate

Systemtic Name: methyl 4-[[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-propanoyl-amino]benzoate Openeye Name: methyl 4-[[4-(4-chlorophenyl)-5-methyl-thiazol-2-yl]-propanoyl-amino]benzoate CAS Name: 4-[[4-(4-chlorophenyl)-5-methyl-2-thiazolyl]-(1-oxopropyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-propanoylamino]benzoate Traditional Name: 4-[[4-(4-chlorophenyl)-5-methyl-thiazol-2-yl]-propionyl-amino]benzoic acid methyl ester Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=C(C=C1)C(=O)OC)C2=NC(=C(S2)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(=O)N(C1=CC=C(C=C1)C(=O)OC)C2=NC(=C(S2)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H19ClN2O3S/c1-4-18(25)24(17-11-7-15(8-12-17)20(26)27-3)21-23-19(13(2)28-21)14-5-9-16(22)10-6-14/h5-12H,4H2,1-3H3