(4S)-6-chloranyl-1-[(4-chlorophenyl)methyl]-4-cyclopropyl-4-(2-pyridin-2-ylethynyl)-3H-quinazolin-2-one

Systemtic Name: (4S)-6-chloranyl-1-[(4-chlorophenyl)methyl]-4-cyclopropyl-4-(2-pyridin-2-ylethynyl)-3H-quinazolin-2-one Openeye Name: (4S)-6-chloro-1-[(4-chlorophenyl)methyl]-4-cyclopropyl-4-[2-(2-pyridyl)ethynyl]-3H-quinazolin-2-one CAS Name: (4S)-6-chloro-1-[(4-chlorophenyl)methyl]-4-cyclopropyl-4-[2-(2-pyridinyl)ethynyl]-3H-quinazolin-2-one IUPAC Name: (4S)-6-chloro-1-[(4-chlorophenyl)methyl]-4-cyclopropyl-4-(2-pyridin-2-ylethynyl)-3H-quinazolin-2-one Traditional Name: (4S)-6-chloro-1-(4-chlorobenzyl)-4-cyclopropyl-4-[2-(2-pyridyl)ethynyl]-3H-quinazolin-2-one Formula: C25H19Cl2N3O MolecularWeight: 448.34386

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2(C3=C(C=CC(=C3)Cl)N(C(=O)N2)CC4=CC=C(C=C4)Cl)C#CC5=CC=CC=N5

Isomeric SMILES

C1CC1[C@@]2(C3=C(C=CC(=C3)Cl)N(C(=O)N2)CC4=CC=C(C=C4)Cl)C#CC5=CC=CC=N5

InChI

InChI=1S/C25H19Cl2N3O/c26-19-8-4-17(5-9-19)16-30-23-11-10-20(27)15-22(23)25(18-6-7-18,29-24(30)31)13-12-21-3-1-2-14-28-21/h1-5,8-11,14-15,18H,6-7,16H2,(H,29,31)/t25-/m1/s1