2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(3-methoxyphenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(3-methoxyphenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(3-methoxyphenyl)methyl]-N-methyl-acetamide CAS Name: 2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]-N-[(3-methoxyphenyl)methyl]-N-methylacetamide IUPAC Name: 2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanyl-N-[(3-methoxyphenyl)methyl]-N-methylacetamide Traditional Name: 2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]-N-m-anisyl-N-methyl-acetamide Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C25H31N3O3S/c1-4-5-6-9-15-28-24(30)21-13-7-8-14-22(21)26-25(28)32-18-23(29)27(2)17-19-11-10-12-20(16-19)31-3/h7-8,10-14,16H,4-6,9,15,17-18H2,1-3H3