[2-(cyclohexylamino)-2-oxidanylidene-ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate

Systemtic Name: [2-(cyclohexylamino)-2-oxidanylidene-ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylethanoate Openeye Name: [2-(cyclohexylamino)-2-oxo-ethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(3-fluorophenyl)-2-imidazolyl]thio]acetic acid [2-(cyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylamino)-2-oxoethyl] 2-[1-(3-fluorophenyl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(3-fluorophenyl)imidazol-2-yl]thio]acetic acid [2-(cyclohexylamino)-2-keto-ethyl] ester Formula: C19H22FN3O3S MolecularWeight: 391.459683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)COC(=O)CSC2=NC=CN2C3=CC(=CC=C3)F

Isomeric SMILES

C1CCC(CC1)NC(=O)COC(=O)CSC2=NC=CN2C3=CC(=CC=C3)F

InChI

InChI=1S/C19H22FN3O3S/c20-14-5-4-8-16(11-14)23-10-9-21-19(23)27-13-18(25)26-12-17(24)22-15-6-2-1-3-7-15/h4-5,8-11,15H,1-3,6-7,12-13H2,(H,22,24)