N-[(5E)-5-(5-phenyl-1,2-dihydro-1,2,4-triazol-3-ylidene)imidazol-4-yl]heptanamide

Systemtic Name: N-[(5E)-5-(5-phenyl-1,2-dihydro-1,2,4-triazol-3-ylidene)imidazol-4-yl]heptanamide Openeye Name: N-[(5E)-5-(5-phenyl-1,2-dihydro-1,2,4-triazol-3-ylidene)imidazol-4-yl]heptanamide CAS Name: N-[(5E)-5-(5-phenyl-1,2-dihydro-1,2,4-triazol-3-ylidene)-4-imidazolyl]heptanamide IUPAC Name: N-[(5E)-5-(5-phenyl-1,2-dihydro-1,2,4-triazol-3-ylidene)imidazol-4-yl]heptanamide Traditional Name: N-[(5E)-5-(5-phenyl-1,2-dihydro-1,2,4-triazol-3-ylidene)imidazol-4-yl]enanthamide Formula: C18H22N6O MolecularWeight: 338.40688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC1=NC=NC1=C2NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCC(=O)NC\1=NC=N/C1=C\2/NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H22N6O/c1-2-3-4-8-11-14(25)21-17-15(19-12-20-17)18-22-16(23-24-18)13-9-6-5-7-10-13/h5-7,9-10,12,24H,2-4,8,11H2,1H3,(H,22,23)(H,19,20,21,25)/b18-15+