[(4Z)-4-(4-pyridin-4-yl-1,2-dihydro-1,2,3-triazol-5-ylidene)pyrrol-2-yl] N-phenylcarbamate

Systemtic Name: [(4Z)-4-(4-pyridin-4-yl-1,2-dihydro-1,2,3-triazol-5-ylidene)pyrrol-2-yl] N-phenylcarbamate Openeye Name: [(4Z)-4-[4-(4-pyridyl)-1,2-dihydrotriazol-5-ylidene]pyrrol-2-yl] N-phenylcarbamate CAS Name: N-phenylcarbamic acid [(4Z)-4-(4-pyridin-4-yl-1,2-dihydrotriazol-5-ylidene)-2-pyrrolyl] ester IUPAC Name: [(4Z)-4-(4-pyridin-4-yl-1,2-dihydrotriazol-5-ylidene)pyrrol-2-yl] N-phenylcarbamate Traditional Name: N-phenylcarbamic acid [(4Z)-4-[4-(4-pyridyl)-1,2-dihydrotriazol-5-ylidene]pyrrol-2-yl] ester Formula: C18H14N6O2 MolecularWeight: 346.34276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)OC2=CC(=C3C(=NNN3)C4=CC=NC=C4)C=N2

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)OC2=C/C(=C/3\C(=NNN3)C4=CC=NC=C4)/C=N2

InChI

InChI=1S/C18H14N6O2/c25-18(21-14-4-2-1-3-5-14)26-15-10-13(11-20-15)17-16(22-24-23-17)12-6-8-19-9-7-12/h1-11,23-24H,(H,21,25)/b17-13-