(2R)-2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]propanamide

Systemtic Name: (2R)-2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]propanamide Openeye Name: (2R)-2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]propanamide CAS Name: (2R)-2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-[2-(1-cyclohexenyl)ethyl]propanamide IUPAC Name: (2R)-2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(cyclohexen-1-yl)ethyl]propanamide Traditional Name: (2R)-2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-[2-(cyclohexen-1-yl)ethyl]propionamide Formula: C21H27ClN4OS MolecularWeight: 418.98328

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NCCC2=CCCCC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)NCCC2=CCCCC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H27ClN4OS/c1-3-26-19(17-9-11-18(22)12-10-17)24-25-21(26)28-15(2)20(27)23-14-13-16-7-5-4-6-8-16/h7,9-12,15H,3-6,8,13-14H2,1-2H3,(H,23,27)/t15-/m1/s1