N-(4-cyanophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(4-cyanophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(4-cyanophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(4-cyanophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(4-cyanophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(4-cyanophenyl)-3-[(4-methyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C13H13N5OS MolecularWeight: 287.34022

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCCC(=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CN1C=NN=C1SCCC(=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H13N5OS/c1-18-9-15-17-13(18)20-7-6-12(19)16-11-4-2-10(8-14)3-5-11/h2-5,9H,6-7H2,1H3,(H,16,19)