[3-[(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)amino]phenyl] propanoate

Systemtic Name: [3-[(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)amino]phenyl] propanoate Openeye Name: [3-[(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)amino]phenyl] propanoate CAS Name: propanoic acid [3-[[6-methyl-2-(methylthio)-4-pyrimidinyl]amino]phenyl] ester IUPAC Name: [3-[(6-methyl-2-methylsulfanylpyrimidin-4-yl)amino]phenyl] propanoate Traditional Name: propionic acid [3-[[6-methyl-2-(methylthio)pyrimidin-4-yl]amino]phenyl] ester Formula: C15H17N3O2S MolecularWeight: 303.37938

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=CC(=C1)NC2=NC(=NC(=C2)C)SC

Isomeric SMILES

CCC(=O)OC1=CC=CC(=C1)NC2=NC(=NC(=C2)C)SC

InChI

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