5,6-dimethyl-2-(3-phenoxypropylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-(3-phenoxypropylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-(3-phenoxypropylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-(3-phenoxypropylthio)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-(3-phenoxypropylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-(3-phenoxypropylthio)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C17H18N2O2S2 MolecularWeight: 346.46702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)SCCCOC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)SCCCOC3=CC=CC=C3)C

InChI

InChI=1S/C17H18N2O2S2/c1-11-12(2)23-16-14(11)15(20)18-17(19-16)22-10-6-9-21-13-7-4-3-5-8-13/h3-5,7-8H,6,9-10H2,1-2H3,(H,18,19,20)