2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(oxolan-2-ylmethyl)ethanamide

Systemtic Name: 2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(oxolan-2-ylmethyl)ethanamide Openeye Name: 2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: 2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]-N-(2-oxolanylmethyl)acetamide IUPAC Name: 2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanyl-N-(oxolan-2-ylmethyl)acetamide Traditional Name: 2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]-N-(tetrahydrofurfuryl)acetamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3CCCO3

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3CCCO3

InChI

InChI=1S/C21H29N3O3S/c1-2-3-4-7-12-24-20(26)17-10-5-6-11-18(17)23-21(24)28-15-19(25)22-14-16-9-8-13-27-16/h5-6,10-11,16H,2-4,7-9,12-15H2,1H3,(H,22,25)