methyl 2-[[cyclohexyl-[(3-fluorophenyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[cyclohexyl-[(3-fluorophenyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[cyclohexyl-[(3-fluorophenyl)carbamoyl]amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[cyclohexyl-[(3-fluoroanilino)-oxomethyl]amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[cyclohexyl-[(3-fluorophenyl)carbamoyl]amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[cyclohexyl-[(3-fluorophenyl)carbamoyl]amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C19H22FN3O3S MolecularWeight: 391.459683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=N1)CN(C2CCCCC2)C(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

COC(=O)C1=CSC(=N1)CN(C2CCCCC2)C(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C19H22FN3O3S/c1-26-18(24)16-12-27-17(22-16)11-23(15-8-3-2-4-9-15)19(25)21-14-7-5-6-13(20)10-14/h5-7,10,12,15H,2-4,8-9,11H2,1H3,(H,21,25)