2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N,N-bis(phenylmethyl)propanamide

Systemtic Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N,N-bis(phenylmethyl)propanamide Openeye Name: N,N-dibenzyl-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-N,N-bis(phenylmethyl)propanamide IUPAC Name: N,N-dibenzyl-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N,N-dibenzyl-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C26H32N4OS MolecularWeight: 448.62348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SC(C)C(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SC(C)C(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H32N4OS/c1-20(32-26-28-27-21(2)30(26)24-16-10-5-11-17-24)25(31)29(18-22-12-6-3-7-13-22)19-23-14-8-4-9-15-23/h3-4,6-9,12-15,20,24H,5,10-11,16-19H2,1-2H3