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

Systemtic Name: 2-[4-oxidanylidene-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[3-(3-isopropoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[4-oxo-3-(3-propan-2-yloxypropyl)-2-quinazolinyl]thio]-N-phenylacetamide IUPAC Name: 2-[4-oxo-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[3-(3-isopropoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-phenyl-acetamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)OCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O3S/c1-16(2)28-14-8-13-25-21(27)18-11-6-7-12-19(18)24-22(25)29-15-20(26)23-17-9-4-3-5-10-17/h3-7,9-12,16H,8,13-15H2,1-2H3,(H,23,26)