[2-oxidanylidene-2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]amino]ethyl] 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]amino]ethyl] 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: [2-oxo-2-[[4-(4-phenylphenyl)thiazol-2-yl]amino]ethyl] 2-chloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid [2-oxo-2-[[4-(4-phenylphenyl)-2-thiazolyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]amino]ethyl] 2-chloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-piperidinosulfonyl-benzoic acid [2-keto-2-[[4-(4-phenylphenyl)thiazol-2-yl]amino]ethyl] ester Formula: C29H26ClN3O5S2 MolecularWeight: 596.11684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCC(=O)NC3=NC(=CS3)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCC(=O)NC3=NC(=CS3)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H26ClN3O5S2/c30-25-14-13-23(40(36,37)33-15-5-2-6-16-33)17-24(25)28(35)38-18-27(34)32-29-31-26(19-39-29)22-11-9-21(10-12-22)20-7-3-1-4-8-20/h1,3-4,7-14,17,19H,2,5-6,15-16,18H2,(H,31,32,34)