2,5-dithiophen-2-yl-7-(trifluoromethyloxy)-4H-1,3,4-benzotriazepine

Systemtic Name: 2,5-dithiophen-2-yl-7-(trifluoromethyloxy)-4H-1,3,4-benzotriazepine Openeye Name: 2,5-bis(2-thienyl)-7-(trifluoromethoxy)-4H-1,3,4-benzotriazepine CAS Name: 2,5-dithiophen-2-yl-7-(trifluoromethoxy)-4H-1,3,4-benzotriazepine IUPAC Name: 2,5-dithiophen-2-yl-7-(trifluoromethoxy)-4H-1,3,4-benzotriazepine Traditional Name: 2,5-bis(2-thienyl)-7-(trifluoromethoxy)-4H-1,3,4-benzotriazepine Formula: C17H10F3N3OS2 MolecularWeight: 393.40601

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H10F3N3OS2/c18-17(19,20)24-10-5-6-12-11(9-10)15(13-3-1-7-25-13)22-23-16(21-12)14-4-2-8-26-14/h1-9,22H