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

Systemtic Name: 8-bromanyl-4-(4-fluorophenyl)-2-thiophen-2-yl-1H-1,3,5-benzotriazepine Openeye Name: 8-bromo-4-(4-fluorophenyl)-2-(2-thienyl)-1H-1,3,5-benzotriazepine CAS Name: 8-bromo-4-(4-fluorophenyl)-2-thiophen-2-yl-1H-1,3,5-benzotriazepine IUPAC Name: 8-bromo-4-(4-fluorophenyl)-2-thiophen-2-yl-1H-1,3,5-benzotriazepine Traditional Name: 8-bromo-4-(4-fluorophenyl)-2-(2-thienyl)-1H-1,3,5-benzotriazepine Formula: C18H11BrFN3S MolecularWeight: 400.267443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=NC3=C(N2)C=C(C=C3)Br)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CSC(=C1)C2=NC(=NC3=C(N2)C=C(C=C3)Br)C4=CC=C(C=C4)F

InChI

InChI=1S/C18H11BrFN3S/c19-12-5-8-14-15(10-12)22-18(16-2-1-9-24-16)23-17(21-14)11-3-6-13(20)7-4-11/h1-10H,(H,21,22,23)