2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-phenyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-phenyl-N-propan-2-yl-ethanamide Openeye Name: 2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanyl-N-isopropyl-N-phenyl-acetamide CAS Name: 2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]-N-phenyl-N-propan-2-ylacetamide IUPAC Name: 2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanyl-N-phenyl-N-propan-2-ylacetamide Traditional Name: 2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]-N-isopropyl-N-phenyl-acetamide Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O2S/c1-4-5-6-12-17-27-24(30)21-15-10-11-16-22(21)26-25(27)31-18-23(29)28(19(2)3)20-13-8-7-9-14-20/h7-11,13-16,19H,4-6,12,17-18H2,1-3H3