7-bromanyl-5-(3-chlorophenyl)-2-thiophen-2-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-bromanyl-5-(3-chlorophenyl)-2-thiophen-2-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-bromo-5-(3-chlorophenyl)-2-(2-thienyl)-4H-1,3,4-benzotriazepine CAS Name: 7-bromo-5-(3-chlorophenyl)-2-thiophen-2-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-bromo-5-(3-chlorophenyl)-2-thiophen-2-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-bromo-5-(3-chlorophenyl)-2-(2-thienyl)-4H-1,3,4-benzotriazepine Formula: C18H11BrClN3S MolecularWeight: 416.72204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=CS4)Br

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=CS4)Br

InChI

InChI=1S/C18H11BrClN3S/c19-12-6-7-15-14(10-12)17(11-3-1-4-13(20)9-11)22-23-18(21-15)16-5-2-8-24-16/h1-10,22H