2-[2-[[2-[(E)-2-(4-methoxyphenyl)-1-phenyl-ethenyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]oxy]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[[2-[(E)-2-(4-methoxyphenyl)-1-phenyl-ethenyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]oxy]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[[2-[(E)-2-(4-methoxyphenyl)-1-phenyl-vinyl]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl]oxy]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[2-[(E)-2-(4-methoxyphenyl)-1-phenylethenyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]oxy]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[[2-[(E)-2-(4-methoxyphenyl)-1-phenylethenyl]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl]oxy]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[[2-[(E)-2-(4-methoxyphenyl)-1-phenyl-vinyl]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl]oxy]ethyl]isoindoline-1,3-quinone Formula: C35H29N3O4S MolecularWeight: 587.68746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C2=CC=CC=C2)C3=NC(=C4C5=C(CCCC5)SC4=N3)OCCN6C(=O)C7=CC=CC=C7C6=O

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C2=CC=CC=C2)/C3=NC(=C4C5=C(CCCC5)SC4=N3)OCCN6C(=O)C7=CC=CC=C7C6=O

InChI

InChI=1S/C35H29N3O4S/c1-41-24-17-15-22(16-18-24)21-28(23-9-3-2-4-10-23)31-36-32(30-27-13-7-8-14-29(27)43-33(30)37-31)42-20-19-38-34(39)25-11-5-6-12-26(25)35(38)40/h2-6,9-12,15-18,21H,7-8,13-14,19-20H2,1H3/b28-21+