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

Systemtic Name: 3-(3-ethoxypropyl)-5,6-dimethyl-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(3-ethoxypropyl)-5,6-dimethyl-2-phenacylsulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(3-ethoxypropyl)-5,6-dimethyl-2-(phenacylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(3-ethoxypropyl)-5,6-dimethyl-2-phenacylsulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(3-ethoxypropyl)-5,6-dimethyl-2-(phenacylthio)thieno[2,3-d]pyrimidin-4-one Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=CC=C3)SC(=C2C)C

Isomeric SMILES

CCOCCCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=CC=C3)SC(=C2C)C

InChI

InChI=1S/C21H24N2O3S2/c1-4-26-12-8-11-23-20(25)18-14(2)15(3)28-19(18)22-21(23)27-13-17(24)16-9-6-5-7-10-16/h5-7,9-10H,4,8,11-13H2,1-3H3