N-[3-[3-(cyanomethylsulfanyl)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]ethanamide

Systemtic Name: N-[3-[3-(cyanomethylsulfanyl)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-[3-(cyanomethylsulfanyl)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]acetamide CAS Name: N-[3-[3-(cyanomethylthio)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]acetamide IUPAC Name: N-[3-[3-(cyanomethylsulfanyl)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]acetamide Traditional Name: N-[3-[3-(cyanomethylthio)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]acetamide Formula: C15H15N5OS MolecularWeight: 313.3775

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)N2C(=NN=C2SCC#N)C3CC3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)N2C(=NN=C2SCC#N)C3CC3

InChI

InChI=1S/C15H15N5OS/c1-10(21)17-12-3-2-4-13(9-12)20-14(11-5-6-11)18-19-15(20)22-8-7-16/h2-4,9,11H,5-6,8H2,1H3,(H,17,21)