4-chloranyl-N-hexyl-N-[1-[3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]butanamide

Systemtic Name: 4-chloranyl-N-hexyl-N-[1-[3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]butanamide Openeye Name: 4-chloro-N-hexyl-N-[1-[3-(m-tolyl)-4-oxo-quinazolin-2-yl]propyl]butanamide CAS Name: 4-chloro-N-hexyl-N-[1-[3-(3-methylphenyl)-4-oxo-2-quinazolinyl]propyl]butanamide IUPAC Name: 4-chloro-N-hexyl-N-[1-[3-(3-methylphenyl)-4-oxoquinazolin-2-yl]propyl]butanamide Traditional Name: 4-chloro-N-hexyl-N-[1-[4-keto-3-(m-tolyl)quinazolin-2-yl]propyl]butyramide Formula: C28H36ClN3O2 MolecularWeight: 482.05734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC(=C3)C)C(=O)CCCCl

Isomeric SMILES

CCCCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC=CC(=C3)C)C(=O)CCCCl

InChI

InChI=1S/C28H36ClN3O2/c1-4-6-7-10-19-31(26(33)17-12-18-29)25(5-2)27-30-24-16-9-8-15-23(24)28(34)32(27)22-14-11-13-21(3)20-22/h8-9,11,13-16,20,25H,4-7,10,12,17-19H2,1-3H3