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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(6-chloranyl-4-oxidanylidene-quinazolin-3-yl)-N-cyclohexyl-ethanamide Openeye Name: 2-(6-chloro-4-oxo-quinazolin-3-yl)-N-cyclohexyl-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide CAS Name: 2-(6-chloro-4-oxo-3-quinazolinyl)-N-cyclohexyl-N-[(3S)-1,1-dioxo-3-thiolanyl]acetamide IUPAC Name: 2-(6-chloro-4-oxoquinazolin-3-yl)-N-cyclohexyl-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide Traditional Name: 2-(6-chloro-4-keto-quinazolin-3-yl)-N-cyclohexyl-N-[(3S)-1,1-diketothiolan-3-yl]acetamide Formula: C20H24ClN3O4S MolecularWeight: 437.94026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CCS(=O)(=O)C2)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)N([C@H]2CCS(=O)(=O)C2)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Cl

InChI

InChI=1S/C20H24ClN3O4S/c21-14-6-7-18-17(10-14)20(26)23(13-22-18)11-19(25)24(15-4-2-1-3-5-15)16-8-9-29(27,28)12-16/h6-7,10,13,15-16H,1-5,8-9,11-12H2/t16-/m0/s1