2-[4-[(Z)-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(Z)-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(Z)-(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetonitrile CAS Name: 2-[4-[(Z)-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(Z)-(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(Z)-(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetonitrile Formula: C14H13N5OS MolecularWeight: 299.35092

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NNC(=S)N2N=CC3=CC=C(C=C3)OCC#N

Isomeric SMILES

C1CC1C2=NNC(=S)N2/N=C\C3=CC=C(C=C3)OCC#N

InChI

InChI=1S/C14H13N5OS/c15-7-8-20-12-5-1-10(2-6-12)9-16-19-13(11-3-4-11)17-18-14(19)21/h1-2,5-6,9,11H,3-4,8H2,(H,18,21)/b16-9-