2-[[4-(phenylmethyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[[4-(phenylmethyl)-5-pyridin-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[[4-benzyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-(phenylmethyl)-5-(2-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-prop-2-enylacetamide IUPAC Name: 2-[(4-benzyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[[4-benzyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C19H19N5OS MolecularWeight: 365.45206

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CC=N3

Isomeric SMILES

C=CCNC(=O)CSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CC=N3

InChI

InChI=1S/C19H19N5OS/c1-2-11-21-17(25)14-26-19-23-22-18(16-10-6-7-12-20-16)24(19)13-15-8-4-3-5-9-15/h2-10,12H,1,11,13-14H2,(H,21,25)