N-[(2-bromophenyl)methyl]-3-(3-dibenzothiophen-4-ylphenyl)imidazole-4-carboxamide

Systemtic Name: N-[(2-bromophenyl)methyl]-3-(3-dibenzothiophen-4-ylphenyl)imidazole-4-carboxamide Openeye Name: N-[(2-bromophenyl)methyl]-3-(3-dibenzothiophen-4-ylphenyl)imidazole-4-carboxamide CAS Name: N-[(2-bromophenyl)methyl]-3-[3-(4-dibenzothiophenyl)phenyl]-4-imidazolecarboxamide IUPAC Name: N-[(2-bromophenyl)methyl]-3-(3-dibenzothiophen-4-ylphenyl)imidazole-4-carboxamide Traditional Name: N-(2-bromobenzyl)-3-(3-dibenzothiophen-4-ylphenyl)imidazole-4-carboxamide Formula: C29H20BrN3OS MolecularWeight: 538.4576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)C2=CN=CN2C3=CC=CC(=C3)C4=CC=CC5=C4SC6=CC=CC=C56)Br

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)C2=CN=CN2C3=CC=CC(=C3)C4=CC=CC5=C4SC6=CC=CC=C56)Br

InChI

InChI=1S/C29H20BrN3OS/c30-25-13-3-1-7-20(25)16-32-29(34)26-17-31-18-33(26)21-9-5-8-19(15-21)22-11-6-12-24-23-10-2-4-14-27(23)35-28(22)24/h1-15,17-18H,16H2,(H,32,34)