5-[[4-(4-methoxyphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-pentanamide

Systemtic Name: 5-[[4-(4-methoxyphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-pentanamide Openeye Name: 5-[[5-benzyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-pentanamide CAS Name: 5-[[4-(4-methoxyphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-propylpentanamide IUPAC Name: 5-[[5-benzyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propylpentanamide Traditional Name: 5-[[5-benzyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-propyl-valeramide Formula: C24H30N4O2S MolecularWeight: 438.5856

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CCCCSC1=NN=C(N1C2=CC=C(C=C2)OC)CC3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)CCCCSC1=NN=C(N1C2=CC=C(C=C2)OC)CC3=CC=CC=C3

InChI

InChI=1S/C24H30N4O2S/c1-3-16-25-23(29)11-7-8-17-31-24-27-26-22(18-19-9-5-4-6-10-19)28(24)20-12-14-21(30-2)15-13-20/h4-6,9-10,12-15H,3,7-8,11,16-18H2,1-2H3,(H,25,29)