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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-phenylazanylquinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(4-anilinoquinazolin-2-yl)sulfanyl-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide CAS Name: 2-[(4-anilino-2-quinazolinyl)thio]-N-[(3S)-1,1-dioxo-3-thiolanyl]acetamide IUPAC Name: 2-(4-anilinoquinazolin-2-yl)sulfanyl-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide Traditional Name: 2-[(4-anilinoquinazolin-2-yl)thio]-N-[(3S)-1,1-diketothiolan-3-yl]acetamide Formula: C20H20N4O3S2 MolecularWeight: 428.5278

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)CSC2=NC3=CC=CC=C3C(=N2)NC4=CC=CC=C4

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1NC(=O)CSC2=NC3=CC=CC=C3C(=N2)NC4=CC=CC=C4

InChI

InChI=1S/C20H20N4O3S2/c25-18(21-15-10-11-29(26,27)13-15)12-28-20-23-17-9-5-4-8-16(17)19(24-20)22-14-6-2-1-3-7-14/h1-9,15H,10-13H2,(H,21,25)(H,22,23,24)/t15-/m0/s1