N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-butyl-N-(1,1-dioxo-3-thiolanyl)-2-[[4-(ethylamino)-2-quinazolinyl]thio]acetamide IUPAC Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-[4-(ethylamino)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-butyl-N-(1,1-diketothiolan-3-yl)-2-[[4-(ethylamino)quinazolin-2-yl]thio]acetamide Formula: C20H28N4O3S2 MolecularWeight: 436.59132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC3=CC=CC=C3C(=N2)NCC

Isomeric SMILES

CCCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC3=CC=CC=C3C(=N2)NCC

InChI

InChI=1S/C20H28N4O3S2/c1-3-5-11-24(15-10-12-29(26,27)14-15)18(25)13-28-20-22-17-9-7-6-8-16(17)19(23-20)21-4-2/h6-9,15H,3-5,10-14H2,1-2H3,(H,21,22,23)