5-(3,4-dimethoxyphenyl)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3,4-dimethoxyphenyl)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(3,4-dimethoxyphenyl)-2-[2-oxo-2-(1-piperidyl)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(3,4-dimethoxyphenyl)-2-[2-oxo-2-(1-piperidinyl)ethyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(3,4-dimethoxyphenyl)-2-(2-oxo-2-piperidin-1-ylethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(3,4-dimethoxyphenyl)-2-(2-keto-2-piperidino-ethyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CC(=O)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)CC(=O)N4CCCCC4)OC

InChI

InChI=1S/C21H23N3O4S/c1-27-15-7-6-13(10-16(15)28-2)14-12-29-21-19(14)20(26)22-17(23-21)11-18(25)24-8-4-3-5-9-24/h6-7,10,12H,3-5,8-9,11H2,1-2H3,(H,22,23,26)