N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(4-oxo-3-propyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(4-oxo-3-propylquinazolin-2-yl)sulfanylpropanamide Traditional Name: 2-[(4-keto-3-propyl-quinazolin-2-yl)thio]-N-veratryl-propionamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H27N3O4S/c1-5-12-26-22(28)17-8-6-7-9-18(17)25-23(26)31-15(2)21(27)24-14-16-10-11-19(29-3)20(13-16)30-4/h6-11,13,15H,5,12,14H2,1-4H3,(H,24,27)