4-[3-(1,2,4-triazol-1-yl)prop-1-en-2-yl]benzenecarbonitrile

Systemtic Name: 4-[3-(1,2,4-triazol-1-yl)prop-1-en-2-yl]benzenecarbonitrile Openeye Name: 4-[1-(1,2,4-triazol-1-ylmethyl)vinyl]benzonitrile CAS Name: 4-[3-(1,2,4-triazol-1-yl)prop-1-en-2-yl]benzonitrile IUPAC Name: 4-[3-(1,2,4-triazol-1-yl)prop-1-en-2-yl]benzonitrile Traditional Name: 4-[1-(1,2,4-triazol-1-ylmethyl)vinyl]benzonitrile Formula: C12H10N4 MolecularWeight: 210.2346

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CN1C=NC=N1)C2=CC=C(C=C2)C#N

Isomeric SMILES

C=C(CN1C=NC=N1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C12H10N4/c1-10(7-16-9-14-8-15-16)12-4-2-11(6-13)3-5-12/h2-5,8-9H,1,7H2