N-(4-bromanyl-3-methyl-phenyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-1-(1H-imidazol-5-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-1-(1H-imidazol-5-ylsulfonyl)isonipecotamide Formula: C16H19BrN4O3S MolecularWeight: 427.31606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CN3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CN3)Br

InChI

InChI=1S/C16H19BrN4O3S/c1-11-8-13(2-3-14(11)17)20-16(22)12-4-6-21(7-5-12)25(23,24)15-9-18-10-19-15/h2-3,8-10,12H,4-7H2,1H3,(H,18,19)(H,20,22)