3-[3-[(Z)-1,2,4-triazol-4-yliminomethyl]indol-1-yl]propanenitrile

Systemtic Name: 3-[3-[(Z)-1,2,4-triazol-4-yliminomethyl]indol-1-yl]propanenitrile Openeye Name: 3-[3-[(Z)-1,2,4-triazol-4-yliminomethyl]indol-1-yl]propanenitrile CAS Name: 3-[3-[(Z)-1,2,4-triazol-4-yliminomethyl]-1-indolyl]propanenitrile IUPAC Name: 3-[3-[(Z)-1,2,4-triazol-4-yliminomethyl]indol-1-yl]propanenitrile Traditional Name: 3-[3-[(Z)-1,2,4-triazol-4-yliminomethyl]indol-1-yl]propionitrile Formula: C14H12N6 MolecularWeight: 264.28528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCC#N)C=NN3C=NN=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCC#N)/C=N\N3C=NN=C3

InChI

InChI=1S/C14H12N6/c15-6-3-7-19-9-12(8-18-20-10-16-17-11-20)13-4-1-2-5-14(13)19/h1-2,4-5,8-11H,3,7H2/b18-8-