cyclohexyl 2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)butanoate

Systemtic Name: cyclohexyl 2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)butanoate Openeye Name: cyclohexyl 2-(4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)butanoate CAS Name: 2-(4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)butanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)butanoate Traditional Name: 2-(4-keto-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)butyric acid cyclohexyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1CCCCC1)N2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)OC1CCCCC1)N2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N2O3S/c1-2-18(22(26)27-16-11-7-4-8-12-16)24-14-23-20-17(21(24)25)13-19(28-20)15-9-5-3-6-10-15/h3,5-6,9-10,13-14,16,18H,2,4,7-8,11-12H2,1H3