1-[(3-bromophenyl)methyl]-4-(3-phenylpropyl)-2,3-dihydro-1,4-benzodiazepin-5-one

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-(3-phenylpropyl)-2,3-dihydro-1,4-benzodiazepin-5-one Openeye Name: 1-[(3-bromophenyl)methyl]-4-(3-phenylpropyl)-2,3-dihydro-1,4-benzodiazepin-5-one CAS Name: 1-[(3-bromophenyl)methyl]-4-(3-phenylpropyl)-2,3-dihydro-1,4-benzodiazepin-5-one IUPAC Name: 1-[(3-bromophenyl)methyl]-4-(3-phenylpropyl)-2,3-dihydro-1,4-benzodiazepin-5-one Traditional Name: 1-(3-bromobenzyl)-4-(3-phenylpropyl)-2,3-dihydro-1,4-benzodiazepin-5-one Formula: C25H25BrN2O MolecularWeight: 449.3828

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2C(=O)N1CCCC3=CC=CC=C3)CC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(C2=CC=CC=C2C(=O)N1CCCC3=CC=CC=C3)CC4=CC(=CC=C4)Br

InChI

InChI=1S/C25H25BrN2O/c26-22-12-6-10-21(18-22)19-28-17-16-27(15-7-11-20-8-2-1-3-9-20)25(29)23-13-4-5-14-24(23)28/h1-6,8-10,12-14,18H,7,11,15-17,19H2