N-(1,3-benzodioxol-5-yl)-3-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propionamide Formula: C22H17N3O4S MolecularWeight: 419.45308

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CCN3C=NC4=C(C3=O)C(=CS4)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CCN3C=NC4=C(C3=O)C(=CS4)C5=CC=CC=C5

InChI

InChI=1S/C22H17N3O4S/c26-19(24-15-6-7-17-18(10-15)29-13-28-17)8-9-25-12-23-21-20(22(25)27)16(11-30-21)14-4-2-1-3-5-14/h1-7,10-12H,8-9,13H2,(H,24,26)