3,3-dimethyl-1-[(9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl)sulfanyl]butan-2-one

Systemtic Name: 3,3-dimethyl-1-[(9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl)sulfanyl]butan-2-one Openeye Name: 3,3-dimethyl-1-[(9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl)sulfanyl]butan-2-one CAS Name: 3,3-dimethyl-1-[(9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl)thio]-2-butanone IUPAC Name: 3,3-dimethyl-1-[(9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl)sulfanyl]butan-2-one Traditional Name: 3,3-dimethyl-1-[(9-methyl-5H-thiochromeno[4,3-d]pyrimidin-2-yl)thio]butan-2-one Formula: C18H20N2OS2 MolecularWeight: 344.4942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SCC3=CN=C(N=C32)SCC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)SCC3=CN=C(N=C32)SCC(=O)C(C)(C)C

InChI

InChI=1S/C18H20N2OS2/c1-11-5-6-14-13(7-11)16-12(9-22-14)8-19-17(20-16)23-10-15(21)18(2,3)4/h5-8H,9-10H2,1-4H3