7-fluoranyl-5-pyridin-3-yl-2-thiophen-2-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-fluoranyl-5-pyridin-3-yl-2-thiophen-2-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-fluoro-5-(3-pyridyl)-2-(2-thienyl)-4H-1,3,4-benzotriazepine CAS Name: 7-fluoro-5-(3-pyridinyl)-2-thiophen-2-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-fluoro-5-pyridin-3-yl-2-thiophen-2-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-fluoro-5-(3-pyridyl)-2-(2-thienyl)-4H-1,3,4-benzotriazepine Formula: C17H11FN4S MolecularWeight: 322.359443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=CS4)F

Isomeric SMILES

C1=CC(=CN=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=CS4)F

InChI

InChI=1S/C17H11FN4S/c18-12-5-6-14-13(9-12)16(11-3-1-7-19-10-11)21-22-17(20-14)15-4-2-8-23-15/h1-10,21H