ethyl 4-[4-(3-phenylthiophen-2-yl)carbonylpiperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(3-phenylthiophen-2-yl)carbonylpiperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(3-phenylthiophene-2-carbonyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[oxo-(3-phenyl-2-thiophenyl)methyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(3-phenylthiophene-2-carbonyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(3-phenylthiophene-2-carbonyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C24H24N2O5S2 MolecularWeight: 484.58776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CS3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=CS3)C4=CC=CC=C4

InChI

InChI=1S/C24H24N2O5S2/c1-2-31-24(28)19-8-10-20(11-9-19)33(29,30)26-15-13-25(14-16-26)23(27)22-21(12-17-32-22)18-6-4-3-5-7-18/h3-12,17H,2,13-16H2,1H3