N-aminocarbonyl-2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-aminocarbonyl-2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-carbamoyl-2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-carbamoyl-2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-carbamoyl-2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-carbamoyl-2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C18H22FN5O2S MolecularWeight: 391.462983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)SC1=NN=C(N1C2CCCCC2)C3=CC=CC=C3F

Isomeric SMILES

CC(C(=O)NC(=O)N)SC1=NN=C(N1C2CCCCC2)C3=CC=CC=C3F

InChI

InChI=1S/C18H22FN5O2S/c1-11(16(25)21-17(20)26)27-18-23-22-15(13-9-5-6-10-14(13)19)24(18)12-7-3-2-4-8-12/h5-6,9-12H,2-4,7-8H2,1H3,(H3,20,21,25,26)