[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 2-chloranyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 2-chloranyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 2-chloro-5-(4-phenylpiperazin-1-yl)sulfonyl-benzoate CAS Name: 2-chloro-5-[(4-phenyl-1-piperazinyl)sulfonyl]benzoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 2-chloro-5-(4-phenylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 2-chloro-5-(4-phenylpiperazino)sulfonyl-benzoic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C24H24ClN3O5S2 MolecularWeight: 534.04746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)OCC(=O)NCC4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)OCC(=O)NCC4=CC=CS4

InChI

InChI=1S/C24H24ClN3O5S2/c25-22-9-8-20(15-21(22)24(30)33-17-23(29)26-16-19-7-4-14-34-19)35(31,32)28-12-10-27(11-13-28)18-5-2-1-3-6-18/h1-9,14-15H,10-13,16-17H2,(H,26,29)