[5-(5-methylthiophen-2-yl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methyl 3,3-dimethylbutanoate

Systemtic Name: [5-(5-methylthiophen-2-yl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methyl 3,3-dimethylbutanoate Openeye Name: [5-(5-methyl-2-thienyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [5-(5-methyl-2-thiophenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl ester IUPAC Name: [5-(5-methylthiophen-2-yl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [4-keto-5-(5-methyl-2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methyl ester Formula: C18H20N2O3S2 MolecularWeight: 376.493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=CSC3=C2C(=O)NC(=N3)COC(=O)CC(C)(C)C

Isomeric SMILES

CC1=CC=C(S1)C2=CSC3=C2C(=O)NC(=N3)COC(=O)CC(C)(C)C

InChI

InChI=1S/C18H20N2O3S2/c1-10-5-6-12(25-10)11-9-24-17-15(11)16(22)19-13(20-17)8-23-14(21)7-18(2,3)4/h5-6,9H,7-8H2,1-4H3,(H,19,20,22)