N,N-diethyl-2-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethanamide

Systemtic Name: N,N-diethyl-2-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethanamide Openeye Name: N,N-diethyl-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-acetamide CAS Name: N,N-diethyl-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]-2-phenylacetamide IUPAC Name: N,N-diethyl-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-2-phenylacetamide Traditional Name: N,N-diethyl-2-[(5-keto-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]-2-phenyl-acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NNC(=O)N2CCC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)C(C1=CC=CC=C1)SC2=NNC(=O)N2CCC3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2S/c1-3-25(4-2)20(27)19(18-13-9-6-10-14-18)29-22-24-23-21(28)26(22)16-15-17-11-7-5-8-12-17/h5-14,19H,3-4,15-16H2,1-2H3,(H,23,28)