N-[1-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-(3-methylbutyl)hexanamide

Systemtic Name: N-[1-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-(3-methylbutyl)hexanamide Openeye Name: N-[1-[3-(3-chloro-2-methyl-phenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-isopentyl-hexanamide CAS Name: N-[1-[3-(3-chloro-2-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]-N-(3-methylbutyl)hexanamide IUPAC Name: N-[1-[3-(3-chloro-2-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]-N-(3-methylbutyl)hexanamide Traditional Name: N-[1-[3-(3-chloro-2-methyl-phenyl)-4-keto-quinazolin-2-yl]ethyl]-N-isoamyl-hexanamide Formula: C28H36ClN3O2 MolecularWeight: 482.05734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N(CCC(C)C)C(C)C1=NC2=CC=CC=C2C(=O)N1C3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CCCCCC(=O)N(CCC(C)C)C(C)C1=NC2=CC=CC=C2C(=O)N1C3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C28H36ClN3O2/c1-6-7-8-16-26(33)31(18-17-19(2)3)21(5)27-30-24-14-10-9-12-22(24)28(34)32(27)25-15-11-13-23(29)20(25)4/h9-15,19,21H,6-8,16-18H2,1-5H3