2-[2-[benzotriazol-2-yl(phenyl)methyl]-1-benzothiophen-3-yl]-1-phenyl-ethanone

Systemtic Name: 2-[2-[benzotriazol-2-yl(phenyl)methyl]-1-benzothiophen-3-yl]-1-phenyl-ethanone Openeye Name: 2-[2-[benzotriazol-2-yl(phenyl)methyl]benzothiophen-3-yl]-1-phenyl-ethanone CAS Name: 2-[2-[2-benzotriazolyl(phenyl)methyl]-1-benzothiophen-3-yl]-1-phenylethanone IUPAC Name: 2-[2-[benzotriazol-2-yl(phenyl)methyl]-1-benzothiophen-3-yl]-1-phenylethanone Traditional Name: 2-[2-[benzotriazol-2-yl(phenyl)methyl]benzothiophen-3-yl]-1-phenyl-ethanone Formula: C29H21N3OS MolecularWeight: 459.56154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=C(C3=CC=CC=C3S2)CC(=O)C4=CC=CC=C4)N5N=C6C=CC=CC6=N5

Isomeric SMILES

C1=CC=C(C=C1)C(C2=C(C3=CC=CC=C3S2)CC(=O)C4=CC=CC=C4)N5N=C6C=CC=CC6=N5

InChI

InChI=1S/C29H21N3OS/c33-26(20-11-3-1-4-12-20)19-23-22-15-7-10-18-27(22)34-29(23)28(21-13-5-2-6-14-21)32-30-24-16-8-9-17-25(24)31-32/h1-18,28H,19H2