5-[[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]carbamoyl]-1-benzothiophene-2-carboxylic acid

Systemtic Name: 5-[[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]carbamoyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 5-[[4-(3,4-dichlorophenyl)thiazol-2-yl]carbamoyl]benzothiophene-2-carboxylic acid CAS Name: 5-[[[4-(3,4-dichlorophenyl)-2-thiazolyl]amino]-oxomethyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 5-[[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]carbamoyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 5-[[4-(3,4-dichlorophenyl)thiazol-2-yl]carbamoyl]benzothiophene-2-carboxylic acid Formula: C19H10Cl2N2O3S2 MolecularWeight: 449.3303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)SC(=C4)C(=O)O)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)SC(=C4)C(=O)O)Cl)Cl

InChI

InChI=1S/C19H10Cl2N2O3S2/c20-12-3-1-9(6-13(12)21)14-8-27-19(22-14)23-17(24)10-2-4-15-11(5-10)7-16(28-15)18(25)26/h1-8H,(H,25,26)(H,22,23,24)