7-butyl-1,3-dimethyl-5-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione

Systemtic Name: 7-butyl-1,3-dimethyl-5-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-butyl-1,3-dimethyl-5-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-butyl-1,3-dimethyl-5-[[2-(4-methyl-1-piperidinyl)-2-oxoethyl]thio]pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-butyl-1,3-dimethyl-5-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-butyl-5-[[2-keto-2-(4-methylpiperidino)ethyl]thio]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C20H29N5O3S MolecularWeight: 419.54096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C(=N1)SCC(=O)N3CCC(CC3)C)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCCCC1=NC2=C(C(=N1)SCC(=O)N3CCC(CC3)C)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C20H29N5O3S/c1-5-6-7-14-21-17-16(19(27)24(4)20(28)23(17)3)18(22-14)29-12-15(26)25-10-8-13(2)9-11-25/h13H,5-12H2,1-4H3