2-(4-fluorophenyl)-8-methoxy-4-thiophen-2-yl-1H-1,3,5-benzotriazepine

Systemtic Name: 2-(4-fluorophenyl)-8-methoxy-4-thiophen-2-yl-1H-1,3,5-benzotriazepine Openeye Name: 2-(4-fluorophenyl)-8-methoxy-4-(2-thienyl)-1H-1,3,5-benzotriazepine CAS Name: 2-(4-fluorophenyl)-8-methoxy-4-thiophen-2-yl-1H-1,3,5-benzotriazepine IUPAC Name: 2-(4-fluorophenyl)-8-methoxy-4-thiophen-2-yl-1H-1,3,5-benzotriazepine Traditional Name: 2-(4-fluorophenyl)-8-methoxy-4-(2-thienyl)-1H-1,3,5-benzotriazepine Formula: C19H14FN3OS MolecularWeight: 351.397363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N=C(N2)C3=CC=C(C=C3)F)C4=CC=CS4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N=C(N2)C3=CC=C(C=C3)F)C4=CC=CS4

InChI

InChI=1S/C19H14FN3OS/c1-24-14-8-9-15-16(11-14)22-18(12-4-6-13(20)7-5-12)23-19(21-15)17-3-2-10-25-17/h2-11H,1H3,(H,21,22,23)