1-(2-bromophenyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(2-bromophenyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(2-bromophenyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]triazole-4-carboxamide CAS Name: 1-(2-bromophenyl)-N-[2-methyl-4-(4-methyl-1-piperazinyl)phenyl]-4-triazolecarboxamide IUPAC Name: 1-(2-bromophenyl)-N-[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]triazole-4-carboxamide Traditional Name: 1-(2-bromophenyl)-N-[2-methyl-4-(4-methylpiperazino)phenyl]triazole-4-carboxamide Formula: C21H23BrN6O MolecularWeight: 455.35092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3=CN(N=N3)C4=CC=CC=C4Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3=CN(N=N3)C4=CC=CC=C4Br

InChI

InChI=1S/C21H23BrN6O/c1-15-13-16(27-11-9-26(2)10-12-27)7-8-18(15)23-21(29)19-14-28(25-24-19)20-6-4-3-5-17(20)22/h3-8,13-14H,9-12H2,1-2H3,(H,23,29)