N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-(4-fluorophenyl)-4-oxidanylidene-butanamide

Systemtic Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-(4-fluorophenyl)-4-oxidanylidene-butanamide Openeye Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-(4-fluorophenyl)-4-oxo-butanamide CAS Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-4-(4-fluorophenyl)-4-oxobutanamide IUPAC Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-(4-fluorophenyl)-4-oxobutanamide Traditional Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-4-(4-fluorophenyl)-4-keto-butyramide Formula: C21H27FN4O2S MolecularWeight: 418.528083

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1C2CCCC2)CCCNC(=O)CCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CSC1=NN=C(N1C2CCCC2)CCCNC(=O)CCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H27FN4O2S/c1-29-21-25-24-19(26(21)17-5-2-3-6-17)7-4-14-23-20(28)13-12-18(27)15-8-10-16(22)11-9-15/h8-11,17H,2-7,12-14H2,1H3,(H,23,28)