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

Systemtic Name: 2-[[4-[3-(dimethylamino)propyl]-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 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]acetamide IUPAC Name: 2-[[4-[3-(dimethylamino)propyl]-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-[3-(dimethylamino)propyl]-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C14H20N6OS MolecularWeight: 320.4132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N6OS/c1-19(2)8-3-9-20-13(11-4-6-16-7-5-11)17-18-14(20)22-10-12(15)21/h4-7H,3,8-10H2,1-2H3,(H2,15,21)