(2R)-N-cyclohexyl-N-ethyl-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: (2R)-N-cyclohexyl-N-ethyl-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2R)-N-cyclohexyl-N-ethyl-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N-cyclohexyl-N-ethyl-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-N-cyclohexyl-N-ethyl-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: (2R)-N-cyclohexyl-N-ethyl-2-[[5-(4-ethylphenyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C21H30N4OS MolecularWeight: 386.5541

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2)SC(C)C(=O)N(CC)C3CCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2)S[C@H](C)C(=O)N(CC)C3CCCCC3

InChI

InChI=1S/C21H30N4OS/c1-4-16-11-13-17(14-12-16)19-22-21(24-23-19)27-15(3)20(26)25(5-2)18-9-7-6-8-10-18/h11-15,18H,4-10H2,1-3H3,(H,22,23,24)/t15-/m1/s1