N-phenethyl-N-(phenylmethyl)-2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-phenethyl-N-(phenylmethyl)-2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-benzyl-N-phenethyl-2-[[4-[2-(2-thienyl)ethyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-phenethyl-N-(phenylmethyl)-2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-benzyl-N-phenethyl-2-[[4-(2-thiophen-2-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-benzyl-N-phenethyl-2-[[4-[2-(2-thienyl)ethyl]-1,2,4-triazol-3-yl]thio]acetamide Formula: C25H26N4OS2 MolecularWeight: 462.63014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)CSC3=NN=CN3CCC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)CSC3=NN=CN3CCC4=CC=CS4

InChI

InChI=1S/C25H26N4OS2/c30-24(19-32-25-27-26-20-29(25)16-14-23-12-7-17-31-23)28(18-22-10-5-2-6-11-22)15-13-21-8-3-1-4-9-21/h1-12,17,20H,13-16,18-19H2