[2-[[4-(2-chlorophenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl] 4-iodanylbenzoate

Systemtic Name: [2-[[4-(2-chlorophenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl] 4-iodanylbenzoate Openeye Name: [2-[[4-(2-chlorophenyl)thiazol-2-yl]amino]-2-oxo-ethyl] 4-iodobenzoate CAS Name: 4-iodobenzoic acid [2-[[4-(2-chlorophenyl)-2-thiazolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[4-(2-chlorophenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] 4-iodobenzoate Traditional Name: 4-iodobenzoic acid [2-[[4-(2-chlorophenyl)thiazol-2-yl]amino]-2-keto-ethyl] ester Formula: C18H12ClIN2O3S MolecularWeight: 498.72195

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12ClIN2O3S/c19-14-4-2-1-3-13(14)15-10-26-18(21-15)22-16(23)9-25-17(24)11-5-7-12(20)8-6-11/h1-8,10H,9H2,(H,21,22,23)