N-[4-[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]sulfonyl-2-methoxy-phenyl]ethanamide

Systemtic Name: N-[4-[4-[(5-bromanylthiophen-2-yl)methyl]piperazin-1-yl]sulfonyl-2-methoxy-phenyl]ethanamide Openeye Name: N-[4-[4-[(5-bromo-2-thienyl)methyl]piperazin-1-yl]sulfonyl-2-methoxy-phenyl]acetamide CAS Name: N-[4-[[4-[(5-bromo-2-thiophenyl)methyl]-1-piperazinyl]sulfonyl]-2-methoxyphenyl]acetamide IUPAC Name: N-[4-[4-[(5-bromothiophen-2-yl)methyl]piperazin-1-yl]sulfonyl-2-methoxyphenyl]acetamide Traditional Name: N-[4-[4-[(5-bromo-2-thienyl)methyl]piperazino]sulfonyl-2-methoxy-phenyl]acetamide Formula: C18H22BrN3O4S2 MolecularWeight: 488.41898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(S3)Br)OC

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(S3)Br)OC

InChI

InChI=1S/C18H22BrN3O4S2/c1-13(23)20-16-5-4-15(11-17(16)26-2)28(24,25)22-9-7-21(8-10-22)12-14-3-6-18(19)27-14/h3-6,11H,7-10,12H2,1-2H3,(H,20,23)