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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C17H21N3O4S2 MolecularWeight: 395.49634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C17H21N3O4S2/c1-11(2)20-16(22)13-5-3-4-6-14(13)19-17(20)25-9-15(21)18-12-7-8-26(23,24)10-12/h3-6,11-12H,7-10H2,1-2H3,(H,18,21)/t12-/m0/s1