2-(4,6-dimethoxypyrimidin-2-yl)-4-propan-2-yl-pyridine-3-carbothioic S-acid

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)-4-propan-2-yl-pyridine-3-carbothioic S-acid Openeye Name: 2-(4,6-dimethoxypyrimidin-2-yl)-4-isopropyl-pyridine-3-carbothioic S-acid CAS Name: 2-(4,6-dimethoxy-2-pyrimidinyl)-4-propan-2-yl-3-pyridinecarbothioic S-acid IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)-4-propan-2-ylpyridine-3-carbothioic S-acid Traditional Name: 2-(4,6-dimethoxypyrimidin-2-yl)-4-isopropyl-thionicotinic acid Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NC=C1)C2=NC(=CC(=N2)OC)OC)C(=O)S

Isomeric SMILES

CC(C)C1=C(C(=NC=C1)C2=NC(=CC(=N2)OC)OC)C(=O)S

InChI

InChI=1S/C15H17N3O3S/c1-8(2)9-5-6-16-13(12(9)15(19)22)14-17-10(20-3)7-11(18-14)21-4/h5-8H,1-4H3,(H,19,22)