N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)-N-(4-methoxy-3-piperidinosulfonyl-phenyl)propionamide Formula: C21H24N4O5S2 MolecularWeight: 476.56906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCN2C=NC3=C(C2=O)C=CS3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCN2C=NC3=C(C2=O)C=CS3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H24N4O5S2/c1-30-17-6-5-15(13-18(17)32(28,29)25-9-3-2-4-10-25)23-19(26)7-11-24-14-22-20-16(21(24)27)8-12-31-20/h5-6,8,12-14H,2-4,7,9-11H2,1H3,(H,23,26)