N-(2-bromanyl-4-methyl-phenyl)-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-3-(1-piperidylsulfonyl)thiophene-2-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-3-(1-piperidinylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-3-piperidin-1-ylsulfonylthiophene-2-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-3-piperidinosulfonyl-thiophene-2-carboxamide Formula: C17H19BrN2O3S2 MolecularWeight: 443.37836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3)Br

InChI

InChI=1S/C17H19BrN2O3S2/c1-12-5-6-14(13(18)11-12)19-17(21)16-15(7-10-24-16)25(22,23)20-8-3-2-4-9-20/h5-7,10-11H,2-4,8-9H2,1H3,(H,19,21)