2-[3-(4-butan-2-ylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(5-chloranylpyridin-2-yl)ethanamide

Systemtic Name: 2-[3-(4-butan-2-ylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(5-chloranylpyridin-2-yl)ethanamide Openeye Name: N-(5-chloro-2-pyridyl)-2-[4-oxo-3-(4-sec-butylphenyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[3-(4-butan-2-ylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(5-chloro-2-pyridinyl)acetamide IUPAC Name: 2-[3-(4-butan-2-ylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(5-chloropyridin-2-yl)acetamide Traditional Name: N-(5-chloro-2-pyridyl)-2-[[4-keto-3-(4-sec-butylphenyl)quinazolin-2-yl]thio]acetamide Formula: C25H23ClN4O2S MolecularWeight: 478.99372

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=NC=C(C=C4)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C25H23ClN4O2S/c1-3-16(2)17-8-11-19(12-9-17)30-24(32)20-6-4-5-7-21(20)28-25(30)33-15-23(31)29-22-13-10-18(26)14-27-22/h4-14,16H,3,15H2,1-2H3,(H,27,29,31)