N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-6,7-dimethoxy-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: [(3S)-1,1-diketothiolan-3-yl]-[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]amine Formula: C15H16F3N3O4S MolecularWeight: 391.36545

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NC3CCS(=O)(=O)C3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)N[C@H]3CCS(=O)(=O)C3)OC

InChI

InChI=1S/C15H16F3N3O4S/c1-24-11-5-9-10(6-12(11)25-2)20-14(15(16,17)18)21-13(9)19-8-3-4-26(22,23)7-8/h5-6,8H,3-4,7H2,1-2H3,(H,19,20,21)/t8-/m0/s1