(3S,5R)-5-methyl-3-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-oxolan-2-one

Systemtic Name: (3S,5R)-5-methyl-3-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-oxolan-2-one Openeye Name: (3S,5R)-5-methyl-3-(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-tetrahydrofuran-2-one CAS Name: (3S,5R)-5-methyl-3-[(2-methyl-6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]-2-oxolanone IUPAC Name: (3S,5R)-5-methyl-3-(2-methyl-6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyloxolan-2-one Traditional Name: (3S,5R)-5-methyl-3-[(2-methyl-6-phenyl-thieno[2,3-d]pyrimidin-4-yl)thio]tetrahydrofuran-2-one Formula: C18H16N2O2S2 MolecularWeight: 356.46184

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)O1)SC2=NC(=NC3=C2C=C(S3)C4=CC=CC=C4)C

Isomeric SMILES

C[C@@H]1C[C@@H](C(=O)O1)SC2=NC(=NC3=C2C=C(S3)C4=CC=CC=C4)C

InChI

InChI=1S/C18H16N2O2S2/c1-10-8-15(18(21)22-10)24-17-13-9-14(12-6-4-3-5-7-12)23-16(13)19-11(2)20-17/h3-7,9-10,15H,8H2,1-2H3/t10-,15+/m1/s1