5-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-dipropyl-pentanamide

Systemtic Name: 5-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-dipropyl-pentanamide Openeye Name: 5-[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-dipropyl-pentanamide CAS Name: 5-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N,N-dipropylpentanamide IUPAC Name: 5-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-dipropylpentanamide Traditional Name: 5-[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]-N,N-dipropyl-valeramide Formula: C26H34N4OS MolecularWeight: 450.63936

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CCCCSC1=NN=C(N1C2=CC=C(C=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCCN(CCC)C(=O)CCCCSC1=NN=C(N1C2=CC=C(C=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C26H34N4OS/c1-4-18-29(19-5-2)24(31)13-9-10-20-32-26-28-27-25(22-11-7-6-8-12-22)30(26)23-16-14-21(3)15-17-23/h6-8,11-12,14-17H,4-5,9-10,13,18-20H2,1-3H3