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

Systemtic Name: 2-phenacylsulfanyl-3-(3-propan-2-yloxypropyl)-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 3-(3-isopropoxypropyl)-2-phenacylsulfanyl-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 2-(phenacylthio)-3-(3-propan-2-yloxypropyl)-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 2-phenacylsulfanyl-3-(3-propan-2-yloxypropyl)-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 3-(3-isopropoxypropyl)-2-(phenacylthio)benzothiopheno[3,2-d]pyrimidin-4-one Formula: C24H24N2O3S2 MolecularWeight: 452.58896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C(=O)C2=C(C3=CC=CC=C3S2)N=C1SCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)OCCCN1C(=O)C2=C(C3=CC=CC=C3S2)N=C1SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H24N2O3S2/c1-16(2)29-14-8-13-26-23(28)22-21(18-11-6-7-12-20(18)31-22)25-24(26)30-15-19(27)17-9-4-3-5-10-17/h3-7,9-12,16H,8,13-15H2,1-2H3