3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(3,3-dimethyl-2-oxo-butyl)sulfanyl-quinazolin-4-one CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[(3,3-dimethyl-2-oxobutyl)thio]-4-quinazolinone IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(3,3-dimethyl-2-oxobutyl)sulfanylquinazolin-4-one Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[(2-keto-3,3-dimethyl-butyl)thio]quinazolin-4-one Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3COC4=CC=CC=C4O3

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3COC4=CC=CC=C4O3

InChI

InChI=1S/C23H24N2O4S/c1-23(2,3)20(26)14-30-22-24-17-9-5-4-8-16(17)21(27)25(22)12-15-13-28-18-10-6-7-11-19(18)29-15/h4-11,15H,12-14H2,1-3H3