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

Systemtic Name: methyl 4-[[5-ethyl-3-[(4-fluorophenyl)methylcarbamoyl]thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylate Openeye Name: methyl 4-[[5-ethyl-3-[(4-fluorophenyl)methylcarbamoyl]-2-thienyl]carbamoyl]cyclohexanecarboxylate CAS Name: 4-[[[5-ethyl-3-[[(4-fluorophenyl)methylamino]-oxomethyl]-2-thiophenyl]amino]-oxomethyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-[[5-ethyl-3-[(4-fluorophenyl)methylcarbamoyl]thiophen-2-yl]carbamoyl]cyclohexane-1-carboxylate Traditional Name: 4-[[5-ethyl-3-[(4-fluorobenzyl)carbamoyl]-2-thienyl]carbamoyl]cyclohexanecarboxylic acid methyl ester Formula: C23H27FN2O4S MolecularWeight: 446.534883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27FN2O4S/c1-3-18-12-19(21(28)25-13-14-4-10-17(24)11-5-14)22(31-18)26-20(27)15-6-8-16(9-7-15)23(29)30-2/h4-5,10-12,15-16H,3,6-9,13H2,1-2H3,(H,25,28)(H,26,27)