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

Systemtic Name: (2S)-N-cyclohexyl-N-ethyl-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2S)-N-cyclohexyl-N-ethyl-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2S)-N-cyclohexyl-N-ethyl-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2S)-N-cyclohexyl-N-ethyl-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: (2S)-N-cyclohexyl-N-ethyl-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)C(C)SC2=NNC(=N2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN(C1CCCCC1)C(=O)[C@H](C)SC2=NNC(=N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H28N4O2S/c1-4-24(16-8-6-5-7-9-16)19(25)14(2)27-20-21-18(22-23-20)15-10-12-17(26-3)13-11-15/h10-14,16H,4-9H2,1-3H3,(H,21,22,23)/t14-/m0/s1