N-[(3S)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)benzamide

Systemtic Name: N-[(3S)-3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)benzamide Openeye Name: N-[(3S)-3-methyl-1,1-dioxo-thiolan-3-yl]-4-(2-methyl-4-oxo-quinazolin-3-yl)benzamide CAS Name: N-[(3S)-3-methyl-1,1-dioxo-3-thiolanyl]-4-(2-methyl-4-oxo-3-quinazolinyl)benzamide IUPAC Name: N-[(3S)-3-methyl-1,1-dioxothiolan-3-yl]-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide Traditional Name: N-[(3S)-1,1-diketo-3-methyl-thiolan-3-yl]-4-(4-keto-2-methyl-quinazolin-3-yl)benzamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)NC4(CCS(=O)(=O)C4)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)N[C@]4(CCS(=O)(=O)C4)C

InChI

InChI=1S/C21H21N3O4S/c1-14-22-18-6-4-3-5-17(18)20(26)24(14)16-9-7-15(8-10-16)19(25)23-21(2)11-12-29(27,28)13-21/h3-10H,11-13H2,1-2H3,(H,23,25)/t21-/m0/s1