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

Systemtic Name: 1-phenethyl-6-[(1S)-1-phenylethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 1-phenethyl-6-[(1S)-1-phenylethyl]-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 1-phenethyl-6-[(1S)-1-phenylethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 1-phenethyl-6-[(1S)-1-phenylethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 1-phenethyl-6-[(1S)-1-phenylethyl]-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:

CC(C1=CC=CC=C1)N2CC3=C(NC2)N(C(=S)NC3=O)CCC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N2CC3=C(NC2)N(C(=S)NC3=O)CCC4=CC=CC=C4

InChI

InChI=1S/C22H24N4OS/c1-16(18-10-6-3-7-11-18)25-14-19-20(23-15-25)26(22(28)24-21(19)27)13-12-17-8-4-2-5-9-17/h2-11,16,23H,12-15H2,1H3,(H,24,27,28)/t16-/m0/s1