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

Systemtic Name: (2R)-2-[[4-azanyl-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide Openeye Name: (2R)-2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide CAS Name: (2R)-2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]thio]-N-phenylpropanamide IUPAC Name: (2R)-2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylpropanamide Traditional Name: (2R)-2-[[4-amino-5-(2-cyclohexylethyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-propionamide Formula: C19H27N5OS MolecularWeight: 373.51558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=NN=C(N2N)CCC3CCCCC3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)SC2=NN=C(N2N)CCC3CCCCC3

InChI

InChI=1S/C19H27N5OS/c1-14(18(25)21-16-10-6-3-7-11-16)26-19-23-22-17(24(19)20)13-12-15-8-4-2-5-9-15/h3,6-7,10-11,14-15H,2,4-5,8-9,12-13,20H2,1H3,(H,21,25)/t14-/m1/s1