[(2-chloranylpyridin-3-yl)-bis(2-methylsulfanylpyrimidin-4-yl)methyl] ethanoate

Systemtic Name: [(2-chloranylpyridin-3-yl)-bis(2-methylsulfanylpyrimidin-4-yl)methyl] ethanoate Openeye Name: [(2-chloro-3-pyridyl)-bis(2-methylsulfanylpyrimidin-4-yl)methyl] acetate CAS Name: acetic acid [(2-chloro-3-pyridinyl)-bis[2-(methylthio)-4-pyrimidinyl]methyl] ester IUPAC Name: [(2-chloropyridin-3-yl)-bis(2-methylsulfanylpyrimidin-4-yl)methyl] acetate Traditional Name: acetic acid [(2-chloro-3-pyridyl)-bis[2-(methylthio)pyrimidin-4-yl]methyl] ester Formula: C18H16ClN5O2S2 MolecularWeight: 433.93494

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=C(N=CC=C1)Cl)(C2=NC(=NC=C2)SC)C3=NC(=NC=C3)SC

Isomeric SMILES

CC(=O)OC(C1=C(N=CC=C1)Cl)(C2=NC(=NC=C2)SC)C3=NC(=NC=C3)SC

InChI

InChI=1S/C18H16ClN5O2S2/c1-11(25)26-18(12-5-4-8-20-15(12)19,13-6-9-21-16(23-13)27-2)14-7-10-22-17(24-14)28-3/h4-10H,1-3H3