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

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(6-chloranyl-4-phenyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(6-chloro-4-phenyl-quinazolin-2-yl)sulfanyl-N-(1,1-dioxothiolan-3-yl)acetamide CAS Name: 2-[(6-chloro-4-phenyl-2-quinazolinyl)thio]-N-(1,1-dioxo-3-thiolanyl)acetamide IUPAC Name: 2-(6-chloro-4-phenylquinazolin-2-yl)sulfanyl-N-(1,1-dioxothiolan-3-yl)acetamide Traditional Name: 2-[(6-chloro-4-phenyl-quinazolin-2-yl)thio]-N-(1,1-diketothiolan-3-yl)acetamide Formula: C20H18ClN3O3S2 MolecularWeight: 447.95822

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)CSC2=NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

Isomeric SMILES

C1CS(=O)(=O)CC1NC(=O)CSC2=NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C20H18ClN3O3S2/c21-14-6-7-17-16(10-14)19(13-4-2-1-3-5-13)24-20(23-17)28-11-18(25)22-15-8-9-29(26,27)12-15/h1-7,10,15H,8-9,11-12H2,(H,22,25)