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

Systemtic Name: 7-chloranyl-1-(cyclohexylmethyl)-3-fluoranyl-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-1-(cyclohexylmethyl)-3-fluoro-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-1-(cyclohexylmethyl)-3-fluoro-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-1-(cyclohexylmethyl)-3-fluoro-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-1-(cyclohexylmethyl)-3-fluoro-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C22H22ClFN2O MolecularWeight: 384.874283

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C3=C(C=C(C=C3)Cl)C(=NC(C2=O)F)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CN2C3=C(C=C(C=C3)Cl)C(=NC(C2=O)F)C4=CC=CC=C4

InChI

InChI=1S/C22H22ClFN2O/c23-17-11-12-19-18(13-17)20(16-9-5-2-6-10-16)25-21(24)22(27)26(19)14-15-7-3-1-4-8-15/h2,5-6,9-13,15,21H,1,3-4,7-8,14H2