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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C2CCC(CC2)C(=O)OC)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C2CCC(CC2)C(=O)OC)C(=O)NCC3=CC=C(C=C3)F

InChI

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