2-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methoxypropyl)ethanamide

Systemtic Name: 2-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methoxypropyl)ethanamide Openeye Name: 2-[3-(2-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-methoxypropyl)acetamide CAS Name: 2-[[3-(2-chlorophenyl)-4-oxo-2-quinazolinyl]thio]-N-(3-methoxypropyl)acetamide IUPAC Name: 2-[3-(2-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-methoxypropyl)acetamide Traditional Name: 2-[[3-(2-chlorophenyl)-4-keto-quinazolin-2-yl]thio]-N-(3-methoxypropyl)acetamide Formula: C20H20ClN3O3S MolecularWeight: 417.9091

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3Cl

Isomeric SMILES

COCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3Cl

InChI

InChI=1S/C20H20ClN3O3S/c1-27-12-6-11-22-18(25)13-28-20-23-16-9-4-2-7-14(16)19(26)24(20)17-10-5-3-8-15(17)21/h2-5,7-10H,6,11-13H2,1H3,(H,22,25)