2-[[4-(2-morpholin-4-ylethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[4-(2-morpholin-4-ylethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[4-(2-morpholinoethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[4-[2-(4-morpholinyl)ethyl]-5-phenyl-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[4-(2-morpholin-4-ylethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[4-(2-morpholinoethyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN2C(=NN=C2SCC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1CCN2C(=NN=C2SCC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5O2S/c28-20(23-19-9-5-2-6-10-19)17-30-22-25-24-21(18-7-3-1-4-8-18)27(22)12-11-26-13-15-29-16-14-26/h1-10H,11-17H2,(H,23,28)