methyl 2-(3-butyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoate

Systemtic Name: methyl 2-(3-butyl-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoate Openeye Name: methyl 2-(3-butyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoate CAS Name: 2-[(3-butyl-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]propanoic acid methyl ester IUPAC Name: methyl 2-(3-butyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylpropanoate Traditional Name: 2-[(3-butyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]propionic acid methyl ester Formula: C16H22N2O3S2 MolecularWeight: 354.48748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C1SC(C)C(=O)OC)SC(=C2C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C1SC(C)C(=O)OC)SC(=C2C)C

InChI

InChI=1S/C16H22N2O3S2/c1-6-7-8-18-14(19)12-9(2)10(3)22-13(12)17-16(18)23-11(4)15(20)21-5/h11H,6-8H2,1-5H3