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

Systemtic Name: [3-butyl-6-chloranyl-2,4-bis(oxidanylidene)-1H-quinolin-3-yl] thiocyanate Openeye Name: (3-butyl-6-chloro-2,4-dioxo-1H-quinolin-3-yl) thiocyanate CAS Name: thiocyanic acid (3-butyl-6-chloro-2,4-dioxo-1H-quinolin-3-yl) ester IUPAC Name: (3-butyl-6-chloro-2,4-dioxo-1H-quinolin-3-yl) thiocyanate Traditional Name: thiocyanic acid (3-butyl-6-chloro-2,4-diketo-1H-quinolin-3-yl) ester Formula: C14H13ClN2O2S MolecularWeight: 308.78322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClN2O2S/c1-2-3-6-14(20-8-16)12(18)10-7-9(15)4-5-11(10)17-13(14)19/h4-5,7H,2-3,6H2,1H3,(H,17,19)