7-chloranyl-5-(2-fluorophenyl)-1-[1-(phenylmethyl)pyrrolidin-3-yl]-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-5-(2-fluorophenyl)-1-[1-(phenylmethyl)pyrrolidin-3-yl]-3H-1,4-benzodiazepin-2-one Openeye Name: 1-(1-benzylpyrrolidin-3-yl)-7-chloro-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-5-(2-fluorophenyl)-1-[1-(phenylmethyl)-3-pyrrolidinyl]-3H-1,4-benzodiazepin-2-one IUPAC Name: 1-(1-benzylpyrrolidin-3-yl)-7-chloro-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 1-(1-benzylpyrrolidin-3-yl)-7-chloro-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one Formula: C26H23ClFN3O MolecularWeight: 447.931723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N2C(=O)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4F)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CC1N2C(=O)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4F)CC5=CC=CC=C5

InChI

InChI=1S/C26H23ClFN3O/c27-19-10-11-24-22(14-19)26(21-8-4-5-9-23(21)28)29-15-25(32)31(24)20-12-13-30(17-20)16-18-6-2-1-3-7-18/h1-11,14,20H,12-13,15-17H2