N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(1,1-dioxothiolan-3-yl)-2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(1,1-dioxothiolan-3-yl)-2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(1,1-diketothiolan-3-yl)-2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]propionamide Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4CCS(=O)(=O)C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4CCS(=O)(=O)C4

InChI

InChI=1S/C22H23N3O4S2/c1-14-7-9-17(10-8-14)25-21(27)18-5-3-4-6-19(18)24-22(25)30-15(2)20(26)23-16-11-12-31(28,29)13-16/h3-10,15-16H,11-13H2,1-2H3,(H,23,26)