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

Systemtic Name: N-phenethyl-N-(phenylmethyl)-5-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]pentanamide Openeye Name: N-benzyl-5-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenethyl-pentanamide CAS Name: N-phenethyl-N-(phenylmethyl)-5-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]pentanamide IUPAC Name: N-benzyl-5-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenethylpentanamide Traditional Name: N-benzyl-5-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-phenethyl-valeramide Formula: C35H36N4OS MolecularWeight: 560.75154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)CCCCSC3=NN=C(N3C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)CCCCSC3=NN=C(N3C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C35H36N4OS/c40-34(38(28-31-19-9-3-10-20-31)25-24-29-15-5-1-6-16-29)23-13-14-26-41-35-37-36-33(27-30-17-7-2-8-18-30)39(35)32-21-11-4-12-22-32/h1-12,15-22H,13-14,23-28H2