N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-oxidanylidenequinazolin-3-yl)-N-(thiophen-2-ylmethyl)butanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-oxidanylidenequinazolin-3-yl)-N-(thiophen-2-ylmethyl)butanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-oxoquinazolin-3-yl)-N-(2-thienylmethyl)butanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-oxo-3-quinazolinyl)-N-(thiophen-2-ylmethyl)butanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-oxoquinazolin-3-yl)-N-(thiophen-2-ylmethyl)butanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(4-ketoquinazolin-3-yl)-N-(2-thenyl)butyramide Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N(CC3=CC=CS3)C(=O)CCCN4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N(CC3=CC=CS3)C(=O)CCCN4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C25H23N3O4S/c29-24(8-3-11-27-17-26-21-7-2-1-6-20(21)25(27)30)28(16-19-5-4-14-33-19)18-9-10-22-23(15-18)32-13-12-31-22/h1-2,4-7,9-10,14-15,17H,3,8,11-13,16H2