(2R)-2-[[4-azanyl-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enyl-propanamide

Systemtic Name: (2R)-2-[[4-azanyl-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enyl-propanamide Openeye Name: (2R)-N-allyl-2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]thio]-N-prop-2-enylpropanamide IUPAC Name: (2R)-2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylpropanamide Traditional Name: (2R)-N-allyl-2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C16H27N5OS MolecularWeight: 337.48348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)SC1=NN=C(N1N)CCC2CCCCC2

Isomeric SMILES

C[C@H](C(=O)NCC=C)SC1=NN=C(N1N)CCC2CCCCC2

InChI

InChI=1S/C16H27N5OS/c1-3-11-18-15(22)12(2)23-16-20-19-14(21(16)17)10-9-13-7-5-4-6-8-13/h3,12-13H,1,4-11,17H2,2H3,(H,18,22)/t12-/m1/s1