N-(2,5-dimethylphenyl)-2-(2-ethylsulfanyl-5-oxidanylidene-pyrimido[4,5-d]pyrimidin-6-yl)ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-(2-ethylsulfanyl-5-oxidanylidene-pyrimido[4,5-d]pyrimidin-6-yl)ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-(2-ethylsulfanyl-5-oxo-pyrimido[4,5-d]pyrimidin-6-yl)acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[2-(ethylthio)-5-oxo-6-pyrimido[4,5-d]pyrimidinyl]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-(2-ethylsulfanyl-5-oxopyrimido[4,5-d]pyrimidin-6-yl)acetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[2-(ethylthio)-5-keto-pyrimido[4,5-d]pyrimidin-6-yl]acetamide Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C2C(=N1)N=CN(C2=O)CC(=O)NC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCSC1=NC=C2C(=N1)N=CN(C2=O)CC(=O)NC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C18H19N5O2S/c1-4-26-18-19-8-13-16(22-18)20-10-23(17(13)25)9-15(24)21-14-7-11(2)5-6-12(14)3/h5-8,10H,4,9H2,1-3H3,(H,21,24)