5,6-dimethyl-2-[1-(3-phenoxypropylsulfanyl)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[1-(3-phenoxypropylsulfanyl)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[1-(3-phenoxypropylsulfanyl)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[1-(3-phenoxypropylthio)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[1-(3-phenoxypropylsulfanyl)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[1-(3-phenoxypropylthio)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C19H22N2O2S2 MolecularWeight: 374.52018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O2S2/c1-12-13(2)25-19-16(12)18(22)20-17(21-19)14(3)24-11-7-10-23-15-8-5-4-6-9-15/h4-6,8-9,14H,7,10-11H2,1-3H3,(H,20,21,22)