3-(3-ethoxypropyl)-2-phenacylsulfanyl-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(3-ethoxypropyl)-2-phenacylsulfanyl-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 3-(3-ethoxypropyl)-2-phenacylsulfanyl-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 3-(3-ethoxypropyl)-2-(phenacylthio)-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-(3-ethoxypropyl)-2-phenacylsulfanyl-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 3-(3-ethoxypropyl)-2-(phenacylthio)benzothiopheno[3,2-d]pyrimidin-4-one Formula: C23H22N2O3S2 MolecularWeight: 438.56238

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=C(C3=CC=CC=C3S2)N=C1SCC(=O)C4=CC=CC=C4

Isomeric SMILES

CCOCCCN1C(=O)C2=C(C3=CC=CC=C3S2)N=C1SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O3S2/c1-2-28-14-8-13-25-22(27)21-20(17-11-6-7-12-19(17)30-21)24-23(25)29-15-18(26)16-9-4-3-5-10-16/h3-7,9-12H,2,8,13-15H2,1H3