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

Systemtic Name: 2-[[4-[3-(dimethylamino)propyl]-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[[4-[3-(dimethylamino)propyl]-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-[3-(dimethylamino)propyl]-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]-N-prop-2-enylacetamide IUPAC Name: 2-[[4-[3-(dimethylamino)propyl]-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[[4-[3-(dimethylamino)propyl]-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H24N6OS MolecularWeight: 360.47706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C(=NN=C1SCC(=O)NCC=C)C2=CC=NC=C2

Isomeric SMILES

CN(C)CCCN1C(=NN=C1SCC(=O)NCC=C)C2=CC=NC=C2

InChI

InChI=1S/C17H24N6OS/c1-4-8-19-15(24)13-25-17-21-20-16(14-6-9-18-10-7-14)23(17)12-5-11-22(2)3/h4,6-7,9-10H,1,5,8,11-13H2,2-3H3,(H,19,24)