6-(4-ethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 6-(4-ethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 6-(4-ethylphenyl)-2-(2-methylindolin-1-yl)-5-thioxo-1H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 6-(4-ethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 6-(4-ethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)-5-sulfanylidene-1H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 6-(4-ethylphenyl)-2-(2-methylindolin-1-yl)-5-thioxo-1H-pyrimido[4,5-d]pyrimidin-4-one Formula: C23H21N5OS MolecularWeight: 415.51074

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C=NC3=C(C2=S)C(=O)N=C(N3)N4C(CC5=CC=CC=C54)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C=NC3=C(C2=S)C(=O)N=C(N3)N4C(CC5=CC=CC=C54)C

InChI

InChI=1S/C23H21N5OS/c1-3-15-8-10-17(11-9-15)27-13-24-20-19(22(27)30)21(29)26-23(25-20)28-14(2)12-16-6-4-5-7-18(16)28/h4-11,13-14H,3,12H2,1-2H3,(H,25,26,29)