N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-[2-(3,5-dimethylphenoxy)ethyl]-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-methyl-propionamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCN(C)C(=O)CCN2C(=O)C3=CC=CC=C3NC2=S)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCN(C)C(=O)CCN2C(=O)C3=CC=CC=C3NC2=S)C

InChI

InChI=1S/C22H25N3O3S/c1-15-12-16(2)14-17(13-15)28-11-10-24(3)20(26)8-9-25-21(27)18-6-4-5-7-19(18)23-22(25)29/h4-7,12-14H,8-11H2,1-3H3,(H,23,29)