N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-3-methoxy-4-methyl-benzamide

Systemtic Name: N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-3-methoxy-4-methyl-benzamide Openeye Name: N-[2-[(5-bromo-2-thienyl)methylsulfanyl]ethyl]-3-methoxy-4-methyl-benzamide CAS Name: N-[2-[(5-bromo-2-thiophenyl)methylthio]ethyl]-3-methoxy-4-methylbenzamide IUPAC Name: N-[2-[(5-bromothiophen-2-yl)methylsulfanyl]ethyl]-3-methoxy-4-methylbenzamide Traditional Name: N-[2-[(5-bromo-2-thienyl)methylthio]ethyl]-3-methoxy-4-methyl-benzamide Formula: C16H18BrNO2S2 MolecularWeight: 400.35362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=C(S2)Br)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=C(S2)Br)OC

InChI

InChI=1S/C16H18BrNO2S2/c1-11-3-4-12(9-14(11)20-2)16(19)18-7-8-21-10-13-5-6-15(17)22-13/h3-6,9H,7-8,10H2,1-2H3,(H,18,19)