(4S)-1-(anthracen-9-ylmethyl)-6-chloranyl-4-cyclopropyl-4-(2-pyridin-3-ylethynyl)-3H-quinazolin-2-one

Systemtic Name: (4S)-1-(anthracen-9-ylmethyl)-6-chloranyl-4-cyclopropyl-4-(2-pyridin-3-ylethynyl)-3H-quinazolin-2-one Openeye Name: (4S)-1-(9-anthrylmethyl)-6-chloro-4-cyclopropyl-4-[2-(3-pyridyl)ethynyl]-3H-quinazolin-2-one CAS Name: (4S)-1-(9-anthracenylmethyl)-6-chloro-4-cyclopropyl-4-[2-(3-pyridinyl)ethynyl]-3H-quinazolin-2-one IUPAC Name: (4S)-1-(anthracen-9-ylmethyl)-6-chloro-4-cyclopropyl-4-(2-pyridin-3-ylethynyl)-3H-quinazolin-2-one Traditional Name: (4S)-1-(9-anthrylmethyl)-6-chloro-4-cyclopropyl-4-[2-(3-pyridyl)ethynyl]-3H-quinazolin-2-one Formula: C33H24ClN3O MolecularWeight: 514.01616

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2(C3=C(C=CC(=C3)Cl)N(C(=O)N2)CC4=C5C=CC=CC5=CC6=CC=CC=C64)C#CC7=CN=CC=C7

Isomeric SMILES

C1CC1[C@@]2(C3=C(C=CC(=C3)Cl)N(C(=O)N2)CC4=C5C=CC=CC5=CC6=CC=CC=C64)C#CC7=CN=CC=C7

InChI

InChI=1S/C33H24ClN3O/c34-26-13-14-31-30(19-26)33(25-11-12-25,16-15-22-6-5-17-35-20-22)36-32(38)37(31)21-29-27-9-3-1-7-23(27)18-24-8-2-4-10-28(24)29/h1-10,13-14,17-20,25H,11-12,21H2,(H,36,38)/t33-/m1/s1