3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile

Systemtic Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile Openeye Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile CAS Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]propanenitrile IUPAC Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanenitrile Traditional Name: 3-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]propionitrile Formula: C14H14N4S MolecularWeight: 270.35276

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3=CC=CC=C3)SCCC#N

Isomeric SMILES

C1CC1C2=NN=C(N2C3=CC=CC=C3)SCCC#N

InChI

InChI=1S/C14H14N4S/c15-9-4-10-19-14-17-16-13(11-7-8-11)18(14)12-5-2-1-3-6-12/h1-3,5-6,11H,4,7-8,10H2