4-[7-ethyl-2-(4-fluorophenyl)-4H-1,3,4-benzotriazepin-5-yl]-N,N-dimethyl-aniline

Systemtic Name: 4-[7-ethyl-2-(4-fluorophenyl)-4H-1,3,4-benzotriazepin-5-yl]-N,N-dimethyl-aniline Openeye Name: 4-[7-ethyl-2-(4-fluorophenyl)-4H-1,3,4-benzotriazepin-5-yl]-N,N-dimethyl-aniline CAS Name: 4-[7-ethyl-2-(4-fluorophenyl)-4H-1,3,4-benzotriazepin-5-yl]-N,N-dimethylaniline IUPAC Name: 4-[7-ethyl-2-(4-fluorophenyl)-4H-1,3,4-benzotriazepin-5-yl]-N,N-dimethylaniline Traditional Name: [4-[7-ethyl-2-(4-fluorophenyl)-4H-1,3,4-benzotriazepin-5-yl]phenyl]-dimethyl-amine Formula: C24H23FN4 MolecularWeight: 386.464623

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)F)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)F)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C24H23FN4/c1-4-16-5-14-22-21(15-16)23(17-8-12-20(13-9-17)29(2)3)27-28-24(26-22)18-6-10-19(25)11-7-18/h5-15,27H,4H2,1-3H3