5-phenyl-2-thiophen-2-yl-4H-benzo[i][1,3,4]benzotriazepine

Systemtic Name: 5-phenyl-2-thiophen-2-yl-4H-benzo[i][1,3,4]benzotriazepine Openeye Name: 5-phenyl-2-(2-thienyl)-4H-benzo[i][1,3,4]benzotriazepine CAS Name: 5-phenyl-2-thiophen-2-yl-4H-benzo[i][1,3,4]benzotriazepine IUPAC Name: 5-phenyl-2-thiophen-2-yl-4H-benzo[i][1,3,4]benzotriazepine Traditional Name: 5-phenyl-2-(2-thienyl)-4H-benzo[i][1,3,4]benzotriazepine Formula: C22H15N3S MolecularWeight: 353.4396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC4=CC=CC=C4C3=NC(=NN2)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC4=CC=CC=C4C3=NC(=NN2)C5=CC=CS5

InChI

InChI=1S/C22H15N3S/c1-2-8-16(9-3-1)20-18-13-12-15-7-4-5-10-17(15)21(18)23-22(25-24-20)19-11-6-14-26-19/h1-14,24H