6-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]-2-ethylsulfanyl-pyrimido[4,5-d]pyrimidin-5-one

Systemtic Name: 6-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]-2-ethylsulfanyl-pyrimido[4,5-d]pyrimidin-5-one Openeye Name: 2-ethylsulfanyl-6-(2-indolin-1-yl-2-oxo-ethyl)pyrimido[4,5-d]pyrimidin-5-one CAS Name: 6-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(ethylthio)-5-pyrimido[4,5-d]pyrimidinone IUPAC Name: 6-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-ethylsulfanylpyrimido[4,5-d]pyrimidin-5-one Traditional Name: 2-(ethylthio)-6-(2-indolin-1-yl-2-keto-ethyl)pyrimido[4,5-d]pyrimidin-5-one Formula: C18H17N5O2S MolecularWeight: 367.42488

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C2C(=N1)N=CN(C2=O)CC(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CCSC1=NC=C2C(=N1)N=CN(C2=O)CC(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C18H17N5O2S/c1-2-26-18-19-9-13-16(21-18)20-11-22(17(13)25)10-15(24)23-8-7-12-5-3-4-6-14(12)23/h3-6,9,11H,2,7-8,10H2,1H3