7-chloranyl-1-(2-cyclobutylethyl)-3-fluoranyl-5-phenyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-1-(2-cyclobutylethyl)-3-fluoranyl-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-1-(2-cyclobutylethyl)-3-fluoro-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-1-(2-cyclobutylethyl)-3-fluoro-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-1-(2-cyclobutylethyl)-3-fluoro-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-1-(2-cyclobutylethyl)-3-fluoro-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C21H20ClFN2O MolecularWeight: 370.847703

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)CCN2C3=C(C=C(C=C3)Cl)C(=NC(C2=O)F)C4=CC=CC=C4

Isomeric SMILES

C1CC(C1)CCN2C3=C(C=C(C=C3)Cl)C(=NC(C2=O)F)C4=CC=CC=C4

InChI

InChI=1S/C21H20ClFN2O/c22-16-9-10-18-17(13-16)19(15-7-2-1-3-8-15)24-20(23)21(26)25(18)12-11-14-5-4-6-14/h1-3,7-10,13-14,20H,4-6,11-12H2