2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide Openeye Name: 2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide CAS Name: 2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]-N-[3-(2-oxo-1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide Traditional Name: 2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]-N-[3-(2-ketopyrrolidino)phenyl]acetamide Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC(=C3)N4CCCC4=O

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC(=C3)N4CCCC4=O

InChI

InChI=1S/C26H30N4O3S/c1-2-3-4-7-15-30-25(33)21-12-5-6-13-22(21)28-26(30)34-18-23(31)27-19-10-8-11-20(17-19)29-16-9-14-24(29)32/h5-6,8,10-13,17H,2-4,7,9,14-16,18H2,1H3,(H,27,31)