3-[5-[(3-cyanophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[5-[(3-cyanophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[5-[(3-cyanophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[5-[(3-cyanophenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[5-[(3-cyanophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[5-[(3-cyanobenzyl)thio]-4-methyl-1,2,4-triazol-3-yl]propionamide Formula: C14H15N5OS MolecularWeight: 301.3668

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC(=C2)C#N)CCC(=O)N

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC(=C2)C#N)CCC(=O)N

InChI

InChI=1S/C14H15N5OS/c1-19-13(6-5-12(16)20)17-18-14(19)21-9-11-4-2-3-10(7-11)8-15/h2-4,7H,5-6,9H2,1H3,(H2,16,20)