(4-cyanophenyl) 3-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: (4-cyanophenyl) 3-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: (4-cyanophenyl) 3-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)propionic acid (4-cyanophenyl) ester Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)OC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)OC3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C18H15N3O3S/c1-11-12(2)25-17-16(11)18(23)21(10-20-17)8-7-15(22)24-14-5-3-13(9-19)4-6-14/h3-6,10H,7-8H2,1-2H3