methyl 2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(4-chlorophenyl)ethanoate

Systemtic Name: methyl 2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(4-chlorophenyl)ethanoate Openeye Name: methyl 2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-2-(4-chlorophenyl)acetate CAS Name: 2-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-2-(4-chlorophenyl)acetic acid methyl ester IUPAC Name: methyl 2-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-2-(4-chlorophenyl)acetate Traditional Name: 2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-2-(4-chlorophenyl)acetic acid methyl ester Formula: C17H18BrClN2O4S2 MolecularWeight: 493.82282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

COC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H18BrClN2O4S2/c1-25-17(22)16(12-2-4-13(19)5-3-12)20-8-10-21(11-9-20)27(23,24)15-7-6-14(18)26-15/h2-7,16H,8-11H2,1H3