2-[3-[2-[di(propan-2-yl)amino]ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-prop-2-ynyl-ethanamide

Systemtic Name: 2-[3-[2-[di(propan-2-yl)amino]ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-prop-2-ynyl-ethanamide Openeye Name: 2-[3-[2-(diisopropylamino)ethyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-prop-2-ynyl-acetamide CAS Name: 2-[[3-[2-[di(propan-2-yl)amino]ethyl]-4-oxo-2-quinazolinyl]thio]-N-prop-2-ynylacetamide IUPAC Name: 2-[3-[2-[di(propan-2-yl)amino]ethyl]-4-oxoquinazolin-2-yl]sulfanyl-N-prop-2-ynylacetamide Traditional Name: 2-[[3-[2-(diisopropylamino)ethyl]-4-keto-quinazolin-2-yl]thio]-N-propargyl-acetamide Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC#C)C(C)C

Isomeric SMILES

CC(C)N(CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC#C)C(C)C

InChI

InChI=1S/C21H28N4O2S/c1-6-11-22-19(26)14-28-21-23-18-10-8-7-9-17(18)20(27)25(21)13-12-24(15(2)3)16(4)5/h1,7-10,15-16H,11-14H2,2-5H3,(H,22,26)