3-(3-chloranyl-2-methyl-phenyl)-2-[(1R)-1-(pentylamino)ethyl]quinazolin-4-one

Systemtic Name: 3-(3-chloranyl-2-methyl-phenyl)-2-[(1R)-1-(pentylamino)ethyl]quinazolin-4-one Openeye Name: 3-(3-chloro-2-methyl-phenyl)-2-[(1R)-1-(pentylamino)ethyl]quinazolin-4-one CAS Name: 3-(3-chloro-2-methylphenyl)-2-[(1R)-1-(pentylamino)ethyl]-4-quinazolinone IUPAC Name: 3-(3-chloro-2-methylphenyl)-2-[(1R)-1-(pentylamino)ethyl]quinazolin-4-one Traditional Name: 2-[(1R)-1-(amylamino)ethyl]-3-(3-chloro-2-methyl-phenyl)quinazolin-4-one Formula: C22H26ClN3O MolecularWeight: 383.91434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(C)C1=NC2=CC=CC=C2C(=O)N1C3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CCCCCN[C@H](C)C1=NC2=CC=CC=C2C(=O)N1C3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C22H26ClN3O/c1-4-5-8-14-24-16(3)21-25-19-12-7-6-10-17(19)22(27)26(21)20-13-9-11-18(23)15(20)2/h6-7,9-13,16,24H,4-5,8,14H2,1-3H3/t16-/m1/s1