8-methoxy-3-[5-(2-methyl-2,3-dihydroindol-1-yl)-5-oxidanylidene-pentyl]-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-4-one

Systemtic Name: 8-methoxy-3-[5-(2-methyl-2,3-dihydroindol-1-yl)-5-oxidanylidene-pentyl]-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-4-one Openeye Name: 8-methoxy-3-[5-(2-methylindolin-1-yl)-5-oxo-pentyl]-2-thioxo-1,5-dihydropyrimido[5,4-b]indol-4-one CAS Name: 8-methoxy-3-[5-(2-methyl-2,3-dihydroindol-1-yl)-5-oxopentyl]-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-4-one IUPAC Name: 8-methoxy-3-[5-(2-methyl-2,3-dihydroindol-1-yl)-5-oxopentyl]-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-4-one Traditional Name: 3-[5-keto-5-(2-methylindolin-1-yl)pentyl]-8-methoxy-2-thioxo-1,5-dihydropyrimid[5,4-b]indol-4-one Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CCCCN3C(=O)C4=C(C5=C(N4)C=CC(=C5)OC)NC3=S

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)CCCCN3C(=O)C4=C(C5=C(N4)C=CC(=C5)OC)NC3=S

InChI

InChI=1S/C25H26N4O3S/c1-15-13-16-7-3-4-8-20(16)29(15)21(30)9-5-6-12-28-24(31)23-22(27-25(28)33)18-14-17(32-2)10-11-19(18)26-23/h3-4,7-8,10-11,14-15,26H,5-6,9,12-13H2,1-2H3,(H,27,33)