N,N-bis(phenylmethyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N,N-bis(phenylmethyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N,N-dibenzyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N,N-bis(phenylmethyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N,N-dibenzyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N,N-dibenzyl-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)CSC3=NC=NN3

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)CSC3=NC=NN3

InChI

InChI=1S/C18H18N4OS/c23-17(13-24-18-19-14-20-21-18)22(11-15-7-3-1-4-8-15)12-16-9-5-2-6-10-16/h1-10,14H,11-13H2,(H,19,20,21)