3-(2-methoxyethyl)-5,6-dimethyl-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(2-methoxyethyl)-5,6-dimethyl-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(2-methoxyethyl)-5,6-dimethyl-2-(4-oxo-4-phenyl-butyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(2-methoxyethyl)-5,6-dimethyl-2-[(4-oxo-4-phenylbutyl)thio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(2-methoxyethyl)-5,6-dimethyl-2-(4-oxo-4-phenylbutyl)sulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-keto-4-phenyl-butyl)thio]-3-(2-methoxyethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCCCC(=O)C3=CC=CC=C3)CCOC)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCCCC(=O)C3=CC=CC=C3)CCOC)C

InChI

InChI=1S/C21H24N2O3S2/c1-14-15(2)28-19-18(14)20(25)23(11-12-26-3)21(22-19)27-13-7-10-17(24)16-8-5-4-6-9-16/h4-6,8-9H,7,10-13H2,1-3H3