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

Systemtic Name: 4-(7-ethyl-2-pyridin-4-yl-4H-1,3,4-benzotriazepin-5-yl)-N,N-dimethyl-aniline Openeye Name: 4-[7-ethyl-2-(4-pyridyl)-4H-1,3,4-benzotriazepin-5-yl]-N,N-dimethyl-aniline CAS Name: 4-(7-ethyl-2-pyridin-4-yl-4H-1,3,4-benzotriazepin-5-yl)-N,N-dimethylaniline IUPAC Name: 4-(7-ethyl-2-pyridin-4-yl-4H-1,3,4-benzotriazepin-5-yl)-N,N-dimethylaniline Traditional Name: [4-[7-ethyl-2-(4-pyridyl)-4H-1,3,4-benzotriazepin-5-yl]phenyl]-dimethyl-amine Formula: C23H23N5 MolecularWeight: 369.46222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N5/c1-4-16-5-10-21-20(15-16)22(17-6-8-19(9-7-17)28(2)3)26-27-23(25-21)18-11-13-24-14-12-18/h5-15,26H,4H2,1-3H3