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

Systemtic Name: [1-methyl-2,4-bis(oxidanylidene)-3-(phenylmethyl)quinolin-3-yl] thiocyanate Openeye Name: (3-benzyl-1-methyl-2,4-dioxo-3-quinolyl) thiocyanate CAS Name: thiocyanic acid [1-methyl-2,4-dioxo-3-(phenylmethyl)-3-quinolinyl] ester IUPAC Name: (3-benzyl-1-methyl-2,4-dioxoquinolin-3-yl) thiocyanate Traditional Name: thiocyanic acid (3-benzyl-2,4-diketo-1-methyl-3-quinolyl) ester Formula: C18H14N2O2S MolecularWeight: 322.38096

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C(C1=O)(CC3=CC=CC=C3)SC#N

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C(C1=O)(CC3=CC=CC=C3)SC#N

InChI

InChI=1S/C18H14N2O2S/c1-20-15-10-6-5-9-14(15)16(21)18(17(20)22,23-12-19)11-13-7-3-2-4-8-13/h2-10H,11H2,1H3