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

Systemtic Name: 7-tert-butyl-1,3-dimethyl-5-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-tert-butyl-1,3-dimethyl-5-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-tert-butyl-1,3-dimethyl-5-[[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]thio]pyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-tert-butyl-1,3-dimethyl-5-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-tert-butyl-5-[[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]thio]-1,3-dimethyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)CSC3=NC(=NC4=C3C(=O)N(C(=O)N4C)C)C(C)(C)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)CSC3=NC(=NC4=C3C(=O)N(C(=O)N4C)C)C(C)(C)C

InChI

InChI=1S/C23H25N5O3S/c1-12-16(13-9-7-8-10-14(13)24-12)15(29)11-32-19-17-18(25-21(26-19)23(2,3)4)27(5)22(31)28(6)20(17)30/h7-10,24H,11H2,1-6H3