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

Systemtic Name: 7-hexyl-5-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione Openeye Name: 7-hexyl-5-[2-(1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-3-methyl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-dione CAS Name: 7-hexyl-5-[[2-(1H-indol-3-yl)-2-oxoethyl]thio]-3-methyl-1-propylpyrimido[4,5-d]pyrimidine-2,4-dione IUPAC Name: 7-hexyl-5-[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl-3-methyl-1-propylpyrimido[4,5-d]pyrimidine-2,4-dione Traditional Name: 7-hexyl-5-[[2-(1H-indol-3-yl)-2-keto-ethyl]thio]-3-methyl-1-propyl-pyrimido[4,5-d]pyrimidine-2,4-quinone Formula: C26H31N5O3S MolecularWeight: 493.62104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NC2=C(C(=N1)SCC(=O)C3=CNC4=CC=CC=C43)C(=O)N(C(=O)N2CCC)C

Isomeric SMILES

CCCCCCC1=NC2=C(C(=N1)SCC(=O)C3=CNC4=CC=CC=C43)C(=O)N(C(=O)N2CCC)C

InChI

InChI=1S/C26H31N5O3S/c1-4-6-7-8-13-21-28-23-22(25(33)30(3)26(34)31(23)14-5-2)24(29-21)35-16-20(32)18-15-27-19-12-10-9-11-17(18)19/h9-12,15,27H,4-8,13-14,16H2,1-3H3