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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CC(=O)N(C3CCS(=O)(=O)C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CC(=O)N([C@H]3CCS(=O)(=O)C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O4S/c1-15-22-19-10-6-5-9-18(19)21(26)23(15)13-20(25)24(16-7-3-2-4-8-16)17-11-12-29(27,28)14-17/h2-10,17H,11-14H2,1H3/t17-/m0/s1