6-chloranyl-3-cyclobutyl-4-ethynyl-4-phenyl-1H-quinazolin-2-one

Systemtic Name: 6-chloranyl-3-cyclobutyl-4-ethynyl-4-phenyl-1H-quinazolin-2-one Openeye Name: 6-chloro-3-cyclobutyl-4-ethynyl-4-phenyl-1H-quinazolin-2-one CAS Name: 6-chloro-3-cyclobutyl-4-ethynyl-4-phenyl-1H-quinazolin-2-one IUPAC Name: 6-chloro-3-cyclobutyl-4-ethynyl-4-phenyl-1H-quinazolin-2-one Traditional Name: 6-chloro-3-cyclobutyl-4-ethynyl-4-phenyl-1H-quinazolin-2-one Formula: C20H17ClN2O MolecularWeight: 336.81478

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(C2=C(C=CC(=C2)Cl)NC(=O)N1C3CCC3)C4=CC=CC=C4

Isomeric SMILES

C#CC1(C2=C(C=CC(=C2)Cl)NC(=O)N1C3CCC3)C4=CC=CC=C4

InChI

InChI=1S/C20H17ClN2O/c1-2-20(14-7-4-3-5-8-14)17-13-15(21)11-12-18(17)22-19(24)23(20)16-9-6-10-16/h1,3-5,7-8,11-13,16H,6,9-10H2,(H,22,24)