ethyl 4-[(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)amino]benzoate

Systemtic Name: ethyl 4-[(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)amino]benzoate Openeye Name: ethyl 4-[(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)amino]benzoate CAS Name: 4-[[6-methyl-2-(methylthio)-4-pyrimidinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(6-methyl-2-methylsulfanylpyrimidin-4-yl)amino]benzoate Traditional Name: 4-[[6-methyl-2-(methylthio)pyrimidin-4-yl]amino]benzoic acid ethyl ester Formula: C15H17N3O2S MolecularWeight: 303.37938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=C2)C)SC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=C2)C)SC

InChI

InChI=1S/C15H17N3O2S/c1-4-20-14(19)11-5-7-12(8-6-11)17-13-9-10(2)16-15(18-13)21-3/h5-9H,4H2,1-3H3,(H,16,17,18)