3-butyl-8-oxidanyl-2-(3,4,5-trimethoxyphenyl)-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 3-butyl-8-oxidanyl-2-(3,4,5-trimethoxyphenyl)-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-butyl-8-hydroxy-2-(3,4,5-trimethoxyphenyl)benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 3-butyl-8-hydroxy-2-(3,4,5-trimethoxyphenyl)-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 3-butyl-8-hydroxy-2-(3,4,5-trimethoxyphenyl)-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-butyl-8-hydroxy-2-(3,4,5-trimethoxyphenyl)benzothiopheno[2,3-d]pyrimidin-4-one Formula: C23H24N2O5S MolecularWeight: 440.51206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C(C1=O)C3=C(S2)C(=CC=C3)O)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CCCCN1C(=NC2=C(C1=O)C3=C(S2)C(=CC=C3)O)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C23H24N2O5S/c1-5-6-10-25-21(13-11-16(28-2)19(30-4)17(12-13)29-3)24-22-18(23(25)27)14-8-7-9-15(26)20(14)31-22/h7-9,11-12,26H,5-6,10H2,1-4H3