4-butyl-N-[1-[3-(4-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-phenethyl-benzamide

Systemtic Name: 4-butyl-N-[1-[3-(4-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-phenethyl-benzamide Openeye Name: 4-butyl-N-[1-[3-(4-chloro-2-methyl-phenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-phenethyl-benzamide CAS Name: 4-butyl-N-[1-[3-(4-chloro-2-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]-N-phenethylbenzamide IUPAC Name: 4-butyl-N-[1-[3-(4-chloro-2-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]-N-phenethylbenzamide Traditional Name: 4-butyl-N-[1-[3-(4-chloro-2-methyl-phenyl)-4-keto-quinazolin-2-yl]ethyl]-N-phenethyl-benzamide Formula: C36H36ClN3O2 MolecularWeight: 578.14294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)C(C)C3=NC4=CC=CC=C4C(=O)N3C5=C(C=C(C=C5)Cl)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)C(C)C3=NC4=CC=CC=C4C(=O)N3C5=C(C=C(C=C5)Cl)C

InChI

InChI=1S/C36H36ClN3O2/c1-4-5-11-28-16-18-29(19-17-28)35(41)39(23-22-27-12-7-6-8-13-27)26(3)34-38-32-15-10-9-14-31(32)36(42)40(34)33-21-20-30(37)24-25(33)2/h6-10,12-21,24,26H,4-5,11,22-23H2,1-3H3