2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamide

Systemtic Name: 2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamide Openeye Name: 2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide CAS Name: 2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide IUPAC Name: 2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanyl-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide Traditional Name: 2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]-N-(2,4,5-trimethoxybenzyl)acetamide Formula: C26H33N3O5S MolecularWeight: 499.62232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3=CC(=C(C=C3OC)OC)OC

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3=CC(=C(C=C3OC)OC)OC

InChI

InChI=1S/C26H33N3O5S/c1-5-6-7-10-13-29-25(31)19-11-8-9-12-20(19)28-26(29)35-17-24(30)27-16-18-14-22(33-3)23(34-4)15-21(18)32-2/h8-9,11-12,14-15H,5-7,10,13,16-17H2,1-4H3,(H,27,30)