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

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

CC1CCCN(C1)C(=O)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C(C)(C)C

Isomeric SMILES

CC1CCCN(C1)C(=O)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C(C)(C)C

InChI

InChI=1S/C20H29N5O3S/c1-12-8-7-9-25(10-12)13(26)11-29-16-14-15(21-18(22-16)20(2,3)4)23(5)19(28)24(6)17(14)27/h12H,7-11H2,1-6H3