2-[7-chloranyl-4-oxidanylidene-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-(3-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-(3-methylsulfanylphenyl)ethanamide Openeye Name: 2-[7-chloro-3-(3-isopropoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-methylsulfanylphenyl)acetamide CAS Name: 2-[[7-chloro-4-oxo-3-(3-propan-2-yloxypropyl)-2-quinazolinyl]thio]-N-[3-(methylthio)phenyl]acetamide IUPAC Name: 2-[7-chloro-4-oxo-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-(3-methylsulfanylphenyl)acetamide Traditional Name: 2-[[7-chloro-3-(3-isopropoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-[3-(methylthio)phenyl]acetamide Formula: C23H26ClN3O3S2 MolecularWeight: 492.05384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CC(C)OCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C23H26ClN3O3S2/c1-15(2)30-11-5-10-27-22(29)19-9-8-16(24)12-20(19)26-23(27)32-14-21(28)25-17-6-4-7-18(13-17)31-3/h4,6-9,12-13,15H,5,10-11,14H2,1-3H3,(H,25,28)