N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(6-chloranyl-4-oxidanylidene-quinazolin-3-yl)-N-cyclopropyl-ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(6-chloranyl-4-oxidanylidene-quinazolin-3-yl)-N-cyclopropyl-ethanamide Openeye Name: 2-(6-chloro-4-oxo-quinazolin-3-yl)-N-cyclopropyl-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide CAS Name: 2-(6-chloro-4-oxo-3-quinazolinyl)-N-cyclopropyl-N-[(3S)-1,1-dioxo-3-thiolanyl]acetamide IUPAC Name: 2-(6-chloro-4-oxoquinazolin-3-yl)-N-cyclopropyl-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide Traditional Name: 2-(6-chloro-4-keto-quinazolin-3-yl)-N-cyclopropyl-N-[(3S)-1,1-diketothiolan-3-yl]acetamide Formula: C17H18ClN3O4S MolecularWeight: 395.86052

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C2CCS(=O)(=O)C2)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Cl

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1N(C2CC2)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Cl

InChI

InChI=1S/C17H18ClN3O4S/c18-11-1-4-15-14(7-11)17(23)20(10-19-15)8-16(22)21(12-2-3-12)13-5-6-26(24,25)9-13/h1,4,7,10,12-13H,2-3,5-6,8-9H2/t13-/m0/s1