N-[1-(5-bromanyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[1-(5-bromanyl-2-methoxy-phenyl)sulfonylpiperidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-[1-(5-bromo-2-methoxy-phenyl)sulfonyl-4-piperidyl]thiophene-2-sulfonamide CAS Name: N-[1-(5-bromo-2-methoxyphenyl)sulfonyl-4-piperidinyl]-2-thiophenesulfonamide IUPAC Name: N-[1-(5-bromo-2-methoxyphenyl)sulfonylpiperidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-(5-bromo-2-methoxy-phenyl)sulfonyl-4-piperidyl]thiophene-2-sulfonamide Formula: C16H19BrN2O5S3 MolecularWeight: 495.43146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCC(CC2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H19BrN2O5S3/c1-24-14-5-4-12(17)11-15(14)27(22,23)19-8-6-13(7-9-19)18-26(20,21)16-3-2-10-25-16/h2-5,10-11,13,18H,6-9H2,1H3