5,6-dimethyl-2-[[(1R)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[[(1R)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[[(1R)-2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[[[(1R)-2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl]thio]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[[(1R)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[[(1R)-2-keto-1-phenyl-2-pyrrolidino-ethyl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC(C3=CC=CC=C3)C(=O)N4CCCC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CS[C@H](C3=CC=CC=C3)C(=O)N4CCCC4)C

InChI

InChI=1S/C21H23N3O2S2/c1-13-14(2)28-20-17(13)19(25)22-16(23-20)12-27-18(15-8-4-3-5-9-15)21(26)24-10-6-7-11-24/h3-5,8-9,18H,6-7,10-12H2,1-2H3,(H,22,23,25)/t18-/m1/s1