2-prop-2-enyl-6-[(Z)-(3-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenolate

Systemtic Name: 2-prop-2-enyl-6-[(Z)-(3-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenolate Openeye Name: 2-allyl-6-[(Z)-[3-(2-pyridyl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate CAS Name: 2-prop-2-enyl-6-[(Z)-[3-(2-pyridinyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate IUPAC Name: 2-prop-2-enyl-6-[(Z)-(3-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenolate Traditional Name: 2-allyl-6-[(Z)-[3-(2-pyridyl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]phenolate Formula: C17H14N5OS- MolecularWeight: 336.39096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC(=C1[O-])C=NN2C(=NNC2=S)C3=CC=CC=N3

Isomeric SMILES

C=CCC1=CC=CC(=C1[O-])/C=N\N2C(=NNC2=S)C3=CC=CC=N3

InChI

InChI=1S/C17H15N5OS/c1-2-6-12-7-5-8-13(15(12)23)11-19-22-16(20-21-17(22)24)14-9-3-4-10-18-14/h2-5,7-11,23H,1,6H2,(H,21,24)/p-1/b19-11-