[4-[[6-(4-methoxyphenyl)-2-methyl-pyrimidin-4-yl]amino]phenyl] thiocyanate

Systemtic Name: [4-[[6-(4-methoxyphenyl)-2-methyl-pyrimidin-4-yl]amino]phenyl] thiocyanate Openeye Name: [4-[[6-(4-methoxyphenyl)-2-methyl-pyrimidin-4-yl]amino]phenyl] thiocyanate CAS Name: thiocyanic acid [4-[[6-(4-methoxyphenyl)-2-methyl-4-pyrimidinyl]amino]phenyl] ester IUPAC Name: [4-[[6-(4-methoxyphenyl)-2-methylpyrimidin-4-yl]amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [4-[[6-(4-methoxyphenyl)-2-methyl-pyrimidin-4-yl]amino]phenyl] ester Formula: C19H16N4OS MolecularWeight: 348.42154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)SC#N)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)SC#N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H16N4OS/c1-13-21-18(14-3-7-16(24-2)8-4-14)11-19(22-13)23-15-5-9-17(10-6-15)25-12-20/h3-11H,1-2H3,(H,21,22,23)