N-[(4-methylphenyl)methyl]-2-(2-methylsulfanyl-5-oxidanylidene-pyrimido[4,5-d]pyrimidin-6-yl)ethanamide

Systemtic Name: N-[(4-methylphenyl)methyl]-2-(2-methylsulfanyl-5-oxidanylidene-pyrimido[4,5-d]pyrimidin-6-yl)ethanamide Openeye Name: 2-(2-methylsulfanyl-5-oxo-pyrimido[4,5-d]pyrimidin-6-yl)-N-(p-tolylmethyl)acetamide CAS Name: N-[(4-methylphenyl)methyl]-2-[2-(methylthio)-5-oxo-6-pyrimido[4,5-d]pyrimidinyl]acetamide IUPAC Name: N-[(4-methylphenyl)methyl]-2-(2-methylsulfanyl-5-oxopyrimido[4,5-d]pyrimidin-6-yl)acetamide Traditional Name: 2-[5-keto-2-(methylthio)pyrimido[4,5-d]pyrimidin-6-yl]-N-(4-methylbenzyl)acetamide Formula: C17H17N5O2S MolecularWeight: 355.41418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CN2C=NC3=NC(=NC=C3C2=O)SC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CN2C=NC3=NC(=NC=C3C2=O)SC

InChI

InChI=1S/C17H17N5O2S/c1-11-3-5-12(6-4-11)7-18-14(23)9-22-10-20-15-13(16(22)24)8-19-17(21-15)25-2/h3-6,8,10H,7,9H2,1-2H3,(H,18,23)