S-[4-(4-methoxyphenyl)-6-methyl-pyrimidin-2-yl] pyridine-2-carbothioate

Systemtic Name: S-[4-(4-methoxyphenyl)-6-methyl-pyrimidin-2-yl] pyridine-2-carbothioate Openeye Name: S-[4-(4-methoxyphenyl)-6-methyl-pyrimidin-2-yl] pyridine-2-carbothioate CAS Name: 2-pyridinecarbothioic acid S-[4-(4-methoxyphenyl)-6-methyl-2-pyrimidinyl] ester IUPAC Name: S-[4-(4-methoxyphenyl)-6-methylpyrimidin-2-yl] pyridine-2-carbothioate Traditional Name: pyridine-2-carbothioic acid S-[4-(4-methoxyphenyl)-6-methyl-pyrimidin-2-yl] ester Formula: C18H15N3O2S MolecularWeight: 337.3956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=C(C=C2)OC)SC(=O)C3=CC=CC=N3

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=C(C=C2)OC)SC(=O)C3=CC=CC=N3

InChI

InChI=1S/C18H15N3O2S/c1-12-11-16(13-6-8-14(23-2)9-7-13)21-18(20-12)24-17(22)15-5-3-4-10-19-15/h3-11H,1-2H3