methyl 4-[[4-(4-iodophenyl)-1,3-thiazol-2-yl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[4-(4-iodophenyl)-1,3-thiazol-2-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[4-(4-iodophenyl)thiazol-2-yl]carbamoyl]benzoate CAS Name: 4-[[[4-(4-iodophenyl)-2-thiazolyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(4-iodophenyl)-1,3-thiazol-2-yl]carbamoyl]benzoate Traditional Name: 4-[[4-(4-iodophenyl)thiazol-2-yl]carbamoyl]benzoic acid methyl ester Formula: C18H13IN2O3S MolecularWeight: 464.27689

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)I

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)I

InChI

InChI=1S/C18H13IN2O3S/c1-24-17(23)13-4-2-12(3-5-13)16(22)21-18-20-15(10-25-18)11-6-8-14(19)9-7-11/h2-10H,1H3,(H,20,21,22)