7-(4-ethoxyphenyl)-1,3-dimethyl-5-(2-piperidin-1-ylethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-(4-ethoxyphenyl)-1,3-dimethyl-5-(2-piperidin-1-ylethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-(4-ethoxyphenyl)-1,3-dimethyl-5-[2-(1-piperidyl)ethylsulfanyl]pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-(4-ethoxyphenyl)-1,3-dimethyl-5-[2-(1-piperidinyl)ethylthio]pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-(4-ethoxyphenyl)-1,3-dimethyl-5-(2-piperidin-1-ylethylsulfanyl)pyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 1,3-dimethyl-5-(2-piperidinoethylthio)-7-p-phenetyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C23H29N5O3S MolecularWeight: 455.57306

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(C(=N2)SCCN4CCCCC4)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(C(=N2)SCCN4CCCCC4)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C23H29N5O3S/c1-4-31-17-10-8-16(9-11-17)19-24-20-18(22(29)27(3)23(30)26(20)2)21(25-19)32-15-14-28-12-6-5-7-13-28/h8-11H,4-7,12-15H2,1-3H3