N-cyclopentyl-2-[3-(3,3-diethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclopentyl-2-[3-(3,3-diethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-cyclopentyl-2-[3-(3,3-diethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-cyclopentyl-2-[[3-(3,3-diethoxypropyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-cyclopentyl-2-[3-(3,3-diethoxypropyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-cyclopentyl-2-[[3-(3,3-diethoxypropyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3CCCC3)OCC

Isomeric SMILES

CCOC(CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3CCCC3)OCC

InChI

InChI=1S/C22H31N3O4S/c1-3-28-20(29-4-2)13-14-25-21(27)17-11-7-8-12-18(17)24-22(25)30-15-19(26)23-16-9-5-6-10-16/h7-8,11-12,16,20H,3-6,9-10,13-15H2,1-2H3,(H,23,26)