2-(2-ethylsulfanyl-5-oxidanylidene-pyrimido[4,5-d]pyrimidin-6-yl)-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-(2-ethylsulfanyl-5-oxidanylidene-pyrimido[4,5-d]pyrimidin-6-yl)-N-(3-phenylpropyl)ethanamide Openeye Name: 2-(2-ethylsulfanyl-5-oxo-pyrimido[4,5-d]pyrimidin-6-yl)-N-(3-phenylpropyl)acetamide CAS Name: 2-[2-(ethylthio)-5-oxo-6-pyrimido[4,5-d]pyrimidinyl]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-(2-ethylsulfanyl-5-oxopyrimido[4,5-d]pyrimidin-6-yl)-N-(3-phenylpropyl)acetamide Traditional Name: 2-[2-(ethylthio)-5-keto-pyrimido[4,5-d]pyrimidin-6-yl]-N-(3-phenylpropyl)acetamide Formula: C19H21N5O2S MolecularWeight: 383.46734

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C2C(=N1)N=CN(C2=O)CC(=O)NCCCC3=CC=CC=C3

Isomeric SMILES

CCSC1=NC=C2C(=N1)N=CN(C2=O)CC(=O)NCCCC3=CC=CC=C3

InChI

InChI=1S/C19H21N5O2S/c1-2-27-19-21-11-15-17(23-19)22-13-24(18(15)26)12-16(25)20-10-6-9-14-7-4-3-5-8-14/h3-5,7-8,11,13H,2,6,9-10,12H2,1H3,(H,20,25)