[5-(2-methylphenyl)-2-methylsulfanyl-pyrimidin-4-yl]carbamic acid

Systemtic Name: [5-(2-methylphenyl)-2-methylsulfanyl-pyrimidin-4-yl]carbamic acid Openeye Name: [2-methylsulfanyl-5-(o-tolyl)pyrimidin-4-yl]carbamic acid CAS Name: [5-(2-methylphenyl)-2-(methylthio)-4-pyrimidinyl]carbamic acid IUPAC Name: [5-(2-methylphenyl)-2-methylsulfanylpyrimidin-4-yl]carbamic acid Traditional Name: [2-(methylthio)-5-(o-tolyl)pyrimidin-4-yl]carbamic acid Formula: C13H13N3O2S MolecularWeight: 275.32622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CN=C(N=C2NC(=O)O)SC

Isomeric SMILES

CC1=CC=CC=C1C2=CN=C(N=C2NC(=O)O)SC

InChI

InChI=1S/C13H13N3O2S/c1-8-5-3-4-6-9(8)10-7-14-12(19-2)15-11(10)16-13(17)18/h3-7H,1-2H3,(H,17,18)(H,14,15,16)