4-[(3-methylphenyl)amino]-2-methylsulfanyl-pyrimidine-5-sulfonamide

Systemtic Name: 4-[(3-methylphenyl)amino]-2-methylsulfanyl-pyrimidine-5-sulfonamide Openeye Name: 4-(3-methylanilino)-2-methylsulfanyl-pyrimidine-5-sulfonamide CAS Name: 4-(3-methylanilino)-2-(methylthio)-5-pyrimidinesulfonamide IUPAC Name: 4-(3-methylanilino)-2-methylsulfanylpyrimidine-5-sulfonamide Traditional Name: 2-(methylthio)-4-(m-toluidino)pyrimidine-5-sulfonamide Formula: C12H14N4O2S2 MolecularWeight: 310.39516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=NC=C2S(=O)(=O)N)SC

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=NC=C2S(=O)(=O)N)SC

InChI

InChI=1S/C12H14N4O2S2/c1-8-4-3-5-9(6-8)15-11-10(20(13,17)18)7-14-12(16-11)19-2/h3-7H,1-2H3,(H2,13,17,18)(H,14,15,16)