2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(4-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(4-methylsulfonylphenyl)ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(4-methylsulfonylphenyl)acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-(4-methylsulfonylphenyl)acetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(4-methylsulfonylphenyl)acetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-(4-mesylphenyl)acetamide Formula: C13H15N5O3S2 MolecularWeight: 353.4199

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C13H15N5O3S2/c1-23(20,21)9-4-2-8(3-5-9)16-12(19)7-22-13-17-10(14)6-11(15)18-13/h2-6H,7H2,1H3,(H,16,19)(H4,14,15,17,18)