5,6-dimethyl-3-(3-methylphenyl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-3-(3-methylphenyl)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-3-(m-tolyl)-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-3-(3-methylphenyl)-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-3-(3-methylphenyl)-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(2-keto-2-pyrrolidino-ethyl)thio]-5,6-dimethyl-3-(m-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)N4CCCC4)SC(=C3C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)N4CCCC4)SC(=C3C)C

InChI

InChI=1S/C21H23N3O2S2/c1-13-7-6-8-16(11-13)24-20(26)18-14(2)15(3)28-19(18)22-21(24)27-12-17(25)23-9-4-5-10-23/h6-8,11H,4-5,9-10,12H2,1-3H3