4-butyl-N-[1-(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)ethyl]-N-phenethyl-benzamide

Systemtic Name: 4-butyl-N-[1-(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)ethyl]-N-phenethyl-benzamide Openeye Name: 4-butyl-N-[1-(7-chloro-4-oxo-1H-quinazolin-2-yl)ethyl]-N-phenethyl-benzamide CAS Name: 4-butyl-N-[1-(7-chloro-4-oxo-1H-quinazolin-2-yl)ethyl]-N-phenethylbenzamide IUPAC Name: 4-butyl-N-[1-(7-chloro-4-oxo-1H-quinazolin-2-yl)ethyl]-N-phenethylbenzamide Traditional Name: 4-butyl-N-[1-(7-chloro-4-keto-1H-quinazolin-2-yl)ethyl]-N-phenethyl-benzamide Formula: C29H30ClN3O2 MolecularWeight: 488.0204

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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=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)C(C)C3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C29H30ClN3O2/c1-3-4-8-22-11-13-23(14-12-22)29(35)33(18-17-21-9-6-5-7-10-21)20(2)27-31-26-19-24(30)15-16-25(26)28(34)32-27/h5-7,9-16,19-20H,3-4,8,17-18H2,1-2H3,(H,31,32,34)