methyl 4-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]carbonylbenzoate

Systemtic Name: methyl 4-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]carbonylbenzoate Openeye Name: methyl 4-[4-[(5-methyl-2-thienyl)sulfonyl]piperazine-1-carbonyl]benzoate CAS Name: 4-[[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(5-methylthiophen-2-yl)sulfonylpiperazine-1-carbonyl]benzoate Traditional Name: 4-[4-[(5-methyl-2-thienyl)sulfonyl]piperazine-1-carbonyl]benzoic acid methyl ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C18H20N2O5S2/c1-13-3-8-16(26-13)27(23,24)20-11-9-19(10-12-20)17(21)14-4-6-15(7-5-14)18(22)25-2/h3-8H,9-12H2,1-2H3