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

Systemtic Name: N-(2-chloranylpyridin-3-yl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chloro-3-pyridyl)acetamide CAS Name: N-(2-chloro-3-pyridinyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-chloropyridin-3-yl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-1,2,4-triazol-3-yl)thio]-N-(2-chloro-3-pyridyl)acetamide Formula: C12H12ClN5OS MolecularWeight: 309.77458

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=NN=C1SCC(=O)NC2=C(N=CC=C2)Cl

Isomeric SMILES

C=CCN1C=NN=C1SCC(=O)NC2=C(N=CC=C2)Cl

InChI

InChI=1S/C12H12ClN5OS/c1-2-6-18-8-15-17-12(18)20-7-10(19)16-9-4-3-5-14-11(9)13/h2-5,8H,1,6-7H2,(H,16,19)