N-(2-bromanyl-4-methyl-phenyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-1-(1H-imidazol-5-ylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-1-(1H-imidazol-5-ylsulfonyl)nipecotamide Formula: C16H19BrN4O3S MolecularWeight: 427.31606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CN=CN3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CN=CN3)Br

InChI

InChI=1S/C16H19BrN4O3S/c1-11-4-5-14(13(17)7-11)20-16(22)12-3-2-6-21(9-12)25(23,24)15-8-18-10-19-15/h4-5,7-8,10,12H,2-3,6,9H2,1H3,(H,18,19)(H,20,22)