2-(3-phenoxypropylsulfanyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(3-phenoxypropylsulfanyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(3-phenoxypropylsulfanyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(3-phenoxypropylthio)-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-(3-phenoxypropylsulfanyl)-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(3-phenoxypropylthio)-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCCCOC4=CC=CC=C4)SC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCCCOC4=CC=CC=C4)SC=C3

InChI

InChI=1S/C21H18N2O2S2/c24-20-18-12-15-26-19(18)22-21(23(20)16-8-3-1-4-9-16)27-14-7-13-25-17-10-5-2-6-11-17/h1-6,8-12,15H,7,13-14H2