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

Systemtic Name: 4-(4-fluorophenyl)-2-thiophen-2-yl-1H-1,3,5-benzotriazepine Openeye Name: 4-(4-fluorophenyl)-2-(2-thienyl)-1H-1,3,5-benzotriazepine CAS Name: 4-(4-fluorophenyl)-2-thiophen-2-yl-1H-1,3,5-benzotriazepine IUPAC Name: 4-(4-fluorophenyl)-2-thiophen-2-yl-1H-1,3,5-benzotriazepine Traditional Name: 4-(4-fluorophenyl)-2-(2-thienyl)-1H-1,3,5-benzotriazepine Formula: C18H12FN3S MolecularWeight: 321.371383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=NC(=N2)C3=CC=C(C=C3)F)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)NC(=NC(=N2)C3=CC=C(C=C3)F)C4=CC=CS4

InChI

InChI=1S/C18H12FN3S/c19-13-9-7-12(8-10-13)17-20-14-4-1-2-5-15(14)21-18(22-17)16-6-3-11-23-16/h1-11H,(H,20,21,22)