(3S)-5-(2-fluorophenyl)-3-methyl-7-pyridin-4-yl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine

Systemtic Name: (3S)-5-(2-fluorophenyl)-3-methyl-7-pyridin-4-yl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine Openeye Name: (3S)-5-(2-fluorophenyl)-3-methyl-7-(4-pyridyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine CAS Name: (3S)-5-(2-fluorophenyl)-3-methyl-7-pyridin-4-yl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine IUPAC Name: (3S)-5-(2-fluorophenyl)-3-methyl-7-pyridin-4-yl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine Traditional Name: (3S)-5-(2-fluorophenyl)-3-methyl-7-(4-pyridyl)-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine Formula: C21H20FN3 MolecularWeight: 333.402003

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNC2=C(C=C(C=C2)C3=CC=NC=C3)C(N1)C4=CC=CC=C4F

Isomeric SMILES

C[C@H]1CNC2=C(C=C(C=C2)C3=CC=NC=C3)C(N1)C4=CC=CC=C4F

InChI

InChI=1S/C21H20FN3/c1-14-13-24-20-7-6-16(15-8-10-23-11-9-15)12-18(20)21(25-14)17-4-2-3-5-19(17)22/h2-12,14,21,24-25H,13H2,1H3/t14-,21?/m0/s1