4-pyridin-4-yl-2-thiophen-2-yl-5H-benzo[g][1,3,5]benzotriazepine

Systemtic Name: 4-pyridin-4-yl-2-thiophen-2-yl-5H-benzo[g][1,3,5]benzotriazepine Openeye Name: 4-(4-pyridyl)-2-(2-thienyl)-5H-benzo[g][1,3,5]benzotriazepine CAS Name: 4-pyridin-4-yl-2-thiophen-2-yl-5H-benzo[g][1,3,5]benzotriazepine IUPAC Name: 4-pyridin-4-yl-2-thiophen-2-yl-5H-benzo[g][1,3,5]benzotriazepine Traditional Name: 4-(4-pyridyl)-2-(2-thienyl)-5H-benzo[g][1,3,5]benzotriazepine Formula: C21H14N4S MolecularWeight: 354.42766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2N=C(N=C(N3)C4=CC=NC=C4)C5=CC=CS5

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2N=C(N=C(N3)C4=CC=NC=C4)C5=CC=CS5

InChI

InChI=1S/C21H14N4S/c1-2-5-16-14(4-1)7-8-17-19(16)24-21(18-6-3-13-26-18)25-20(23-17)15-9-11-22-12-10-15/h1-13H,(H,23,24,25)