N-(4-bromanyl-3-methyl-phenyl)-4-(1-methylbenzimidazol-2-yl)piperazine-1-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-(1-methylbenzimidazol-2-yl)piperazine-1-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-(1-methylbenzimidazol-2-yl)piperazine-1-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-4-(1-methyl-2-benzimidazolyl)-1-piperazinecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-(1-methylbenzimidazol-2-yl)piperazine-1-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-(1-methylbenzimidazol-2-yl)piperazine-1-carboxamide Formula: C20H22BrN5O MolecularWeight: 428.32558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)N2CCN(CC2)C3=NC4=CC=CC=C4N3C)Br

InChI

InChI=1S/C20H22BrN5O/c1-14-13-15(7-8-16(14)21)22-20(27)26-11-9-25(10-12-26)19-23-17-5-3-4-6-18(17)24(19)2/h3-8,13H,9-12H2,1-2H3,(H,22,27)