(4-methylphenyl) 5-chloranyl-2-propylsulfanyl-pyrimidine-4-carboxylate

Systemtic Name: (4-methylphenyl) 5-chloranyl-2-propylsulfanyl-pyrimidine-4-carboxylate Openeye Name: p-tolyl 5-chloro-2-propylsulfanyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(propylthio)-4-pyrimidinecarboxylic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 5-chloro-2-propylsulfanylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-(propylthio)pyrimidine-4-carboxylic acid p-tolyl ester Formula: C15H15ClN2O2S MolecularWeight: 322.8098

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(C(=N1)C(=O)OC2=CC=C(C=C2)C)Cl

Isomeric SMILES

CCCSC1=NC=C(C(=N1)C(=O)OC2=CC=C(C=C2)C)Cl

InChI

InChI=1S/C15H15ClN2O2S/c1-3-8-21-15-17-9-12(16)13(18-15)14(19)20-11-6-4-10(2)5-7-11/h4-7,9H,3,8H2,1-2H3