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

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 2-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)acetate CAS Name: 2-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)acetic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetate Traditional Name: 2-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)acetic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)OCCCC(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)OCCCC(=O)C3=CC=CS3)C

InChI

InChI=1S/C18H18N2O4S2/c1-11-12(2)26-17-16(11)18(23)20(10-19-17)9-15(22)24-7-3-5-13(21)14-6-4-8-25-14/h4,6,8,10H,3,5,7,9H2,1-2H3