ethyl 4-[4-(5-methanoylthiophen-2-yl)piperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(5-methanoylthiophen-2-yl)piperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(5-formyl-2-thienyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-(5-formyl-2-thiophenyl)-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(5-formylthiophen-2-yl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(5-formyl-2-thienyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=C(S3)C=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=C(S3)C=O

InChI

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