(3R)-7-bromanyl-3-(pyridin-3-ylmethyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine

Systemtic Name: (3R)-7-bromanyl-3-(pyridin-3-ylmethyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine Openeye Name: (3R)-7-bromo-3-(3-pyridylmethyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine CAS Name: (3R)-7-bromo-3-(3-pyridinylmethyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine IUPAC Name: (3R)-7-bromo-3-(pyridin-3-ylmethyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine Traditional Name: (3R)-7-bromo-3-(3-pyridylmethyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine Formula: C15H16BrN3 MolecularWeight: 318.21164

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC2=C(N1)C=CC(=C2)Br)CC3=CN=CC=C3

Isomeric SMILES

C1[C@H](NCC2=C(N1)C=CC(=C2)Br)CC3=CN=CC=C3

InChI

InChI=1S/C15H16BrN3/c16-13-3-4-15-12(7-13)9-18-14(10-19-15)6-11-2-1-5-17-8-11/h1-5,7-8,14,18-19H,6,9-10H2/t14-/m1/s1