[3-butyl-6-methyl-2,4-bis(oxidanylidene)-1H-quinolin-3-yl] thiocyanate

Systemtic Name: [3-butyl-6-methyl-2,4-bis(oxidanylidene)-1H-quinolin-3-yl] thiocyanate Openeye Name: (3-butyl-6-methyl-2,4-dioxo-1H-quinolin-3-yl) thiocyanate CAS Name: thiocyanic acid (3-butyl-6-methyl-2,4-dioxo-1H-quinolin-3-yl) ester IUPAC Name: (3-butyl-6-methyl-2,4-dioxo-1H-quinolin-3-yl) thiocyanate Traditional Name: thiocyanic acid (3-butyl-2,4-diketo-6-methyl-1H-quinolin-3-yl) ester Formula: C15H16N2O2S MolecularWeight: 288.36474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)C2=C(C=CC(=C2)C)NC1=O)SC#N

Isomeric SMILES

CCCCC1(C(=O)C2=C(C=CC(=C2)C)NC1=O)SC#N

InChI

InChI=1S/C15H16N2O2S/c1-3-4-7-15(20-9-16)13(18)11-8-10(2)5-6-12(11)17-14(15)19/h5-6,8H,3-4,7H2,1-2H3,(H,17,19)