1-(2,3-dimethylphenyl)-6-phenethyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 1-(2,3-dimethylphenyl)-6-phenethyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 1-(2,3-dimethylphenyl)-6-phenethyl-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 1-(2,3-dimethylphenyl)-6-phenethyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 1-(2,3-dimethylphenyl)-6-phenethyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 1-(2,3-dimethylphenyl)-6-phenethyl-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C3=C(CN(CN3)CCC4=CC=CC=C4)C(=O)NC2=S)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C3=C(CN(CN3)CCC4=CC=CC=C4)C(=O)NC2=S)C

InChI

InChI=1S/C22H24N4OS/c1-15-7-6-10-19(16(15)2)26-20-18(21(27)24-22(26)28)13-25(14-23-20)12-11-17-8-4-3-5-9-17/h3-10,23H,11-14H2,1-2H3,(H,24,27,28)