N-[1-[3-(4-bromophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-butyl-benzenesulfonamide

Systemtic Name: N-[1-[3-(4-bromophenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-N-butyl-benzenesulfonamide Openeye Name: N-[1-[3-(4-bromophenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-butyl-benzenesulfonamide CAS Name: N-[1-[3-(4-bromophenyl)-4-oxo-2-quinazolinyl]ethyl]-N-butylbenzenesulfonamide IUPAC Name: N-[1-[3-(4-bromophenyl)-4-oxoquinazolin-2-yl]ethyl]-N-butylbenzenesulfonamide Traditional Name: N-[1-[3-(4-bromophenyl)-4-keto-quinazolin-2-yl]ethyl]-N-butyl-benzenesulfonamide Formula: C26H26BrN3O3S MolecularWeight: 540.47194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Br)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Br)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H26BrN3O3S/c1-3-4-18-29(34(32,33)22-10-6-5-7-11-22)19(2)25-28-24-13-9-8-12-23(24)26(31)30(25)21-16-14-20(27)15-17-21/h5-17,19H,3-4,18H2,1-2H3