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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N4O2S/c1-30-17-10-16-25-23(29)15-8-9-18-31-24-27-26-22(19-20-11-4-2-5-12-20)28(24)21-13-6-3-7-14-21/h2-7,11-14H,8-10,15-19H2,1H3,(H,25,29)