N-(6-morpholin-4-ylpyridin-3-yl)-3-(4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-(6-morpholin-4-ylpyridin-3-yl)-3-(4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-(6-morpholino-3-pyridyl)-3-(4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-[6-(4-morpholinyl)-3-pyridinyl]-3-(4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)propanamide IUPAC Name: N-(6-morpholin-4-ylpyridin-3-yl)-3-(4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: 3-(4-keto-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-3-yl)-N-(6-morpholino-3-pyridyl)propionamide Formula: C22H25N5O3S MolecularWeight: 439.5306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=CN(C3=O)CCC(=O)NC4=CN=C(C=C4)N5CCOCC5

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=CN(C3=O)CCC(=O)NC4=CN=C(C=C4)N5CCOCC5

InChI

InChI=1S/C22H25N5O3S/c28-19(25-15-5-6-18(23-13-15)26-9-11-30-12-10-26)7-8-27-14-24-21-20(22(27)29)16-3-1-2-4-17(16)31-21/h5-6,13-14H,1-4,7-12H2,(H,25,28)