N-[(5-bromanylthiophen-2-yl)methyl]-N-methyl-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-[(5-bromanylthiophen-2-yl)methyl]-N-methyl-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-[(5-bromo-2-thienyl)methyl]-N-methyl-3-(p-tolylsulfonyl)propanamide CAS Name: N-[(5-bromo-2-thiophenyl)methyl]-N-methyl-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-[(5-bromothiophen-2-yl)methyl]-N-methyl-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-[(5-bromo-2-thienyl)methyl]-N-methyl-3-tosyl-propionamide Formula: C16H18BrNO3S2 MolecularWeight: 416.35302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(C)CC2=CC=C(S2)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N(C)CC2=CC=C(S2)Br

InChI

InChI=1S/C16H18BrNO3S2/c1-12-3-6-14(7-4-12)23(20,21)10-9-16(19)18(2)11-13-5-8-15(17)22-13/h3-8H,9-11H2,1-2H3