4-[[5-ethyl-3-[(4-fluorophenyl)methylcarbamoyl]thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[5-ethyl-3-[(4-fluorophenyl)methylcarbamoyl]thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[5-ethyl-3-[(4-fluorophenyl)methylcarbamoyl]-2-thienyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: 4-[[[5-ethyl-3-[[(4-fluorophenyl)methylamino]-oxomethyl]-2-thiophenyl]amino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[5-ethyl-3-[(4-fluorophenyl)methylcarbamoyl]thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[5-ethyl-3-[(4-fluorobenzyl)carbamoyl]-2-thienyl]carbamoyl]cyclohexanecarboxylic acid Formula: C22H25FN2O4S MolecularWeight: 432.508303

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2CCC(CC2)C(=O)O)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2CCC(CC2)C(=O)O)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN2O4S/c1-2-17-11-18(20(27)24-12-13-3-9-16(23)10-4-13)21(30-17)25-19(26)14-5-7-15(8-6-14)22(28)29/h3-4,9-11,14-15H,2,5-8,12H2,1H3,(H,24,27)(H,25,26)(H,28,29)