5-methyl-3-[2-(5-nitro-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-methyl-3-[2-(5-nitro-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-methyl-3-[2-(5-nitroindolin-1-yl)-2-oxo-ethyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-methyl-3-[2-(5-nitro-2,3-dihydroindol-1-yl)-2-oxoethyl]-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-methyl-3-[2-(5-nitro-2,3-dihydroindol-1-yl)-2-oxoethyl]-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-keto-2-(5-nitroindolin-1-yl)ethyl]-5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C23H18N4O4S MolecularWeight: 446.47842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCC4=C3C=CC(=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCC4=C3C=CC(=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C23H18N4O4S/c1-14-20-22(32-21(14)15-5-3-2-4-6-15)24-13-25(23(20)29)12-19(28)26-10-9-16-11-17(27(30)31)7-8-18(16)26/h2-8,11,13H,9-10,12H2,1H3