4-[[5-chloranyl-3-[(4-fluorophenyl)methylcarbamoyl]thiophen-2-yl]carbamoyl]benzoic acid

Systemtic Name: 4-[[5-chloranyl-3-[(4-fluorophenyl)methylcarbamoyl]thiophen-2-yl]carbamoyl]benzoic acid Openeye Name: 4-[[5-chloro-3-[(4-fluorophenyl)methylcarbamoyl]-2-thienyl]carbamoyl]benzoic acid CAS Name: 4-[[[5-chloro-3-[[(4-fluorophenyl)methylamino]-oxomethyl]-2-thiophenyl]amino]-oxomethyl]benzoic acid IUPAC Name: 4-[[5-chloro-3-[(4-fluorophenyl)methylcarbamoyl]thiophen-2-yl]carbamoyl]benzoic acid Traditional Name: 4-[[5-chloro-3-[(4-fluorobenzyl)carbamoyl]-2-thienyl]carbamoyl]benzoic acid Formula: C20H14ClFN2O4S MolecularWeight: 432.852563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=C(SC(=C2)Cl)NC(=O)C3=CC=C(C=C3)C(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=C(SC(=C2)Cl)NC(=O)C3=CC=C(C=C3)C(=O)O)F

InChI

InChI=1S/C20H14ClFN2O4S/c21-16-9-15(18(26)23-10-11-1-7-14(22)8-2-11)19(29-16)24-17(25)12-3-5-13(6-4-12)20(27)28/h1-9H,10H2,(H,23,26)(H,24,25)(H,27,28)