2-[(4-bromophenyl)-(phenylsulfonyl)amino]-N-(3-piperidin-1-ylpropyl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)-(phenylsulfonyl)amino]-N-(3-piperidin-1-ylpropyl)ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-4-bromo-anilino]-N-[3-(1-piperidyl)propyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-4-bromoanilino]-N-[3-(1-piperidinyl)propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-4-bromoanilino]-N-(3-piperidin-1-ylpropyl)acetamide Traditional Name: 2-(N-besyl-4-bromo-anilino)-N-(3-piperidinopropyl)acetamide Formula: C22H28BrN3O3S MolecularWeight: 494.44502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNC(=O)CN(C2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)CCCNC(=O)CN(C2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28BrN3O3S/c23-19-10-12-20(13-11-19)26(30(28,29)21-8-3-1-4-9-21)18-22(27)24-14-7-17-25-15-5-2-6-16-25/h1,3-4,8-13H,2,5-7,14-18H2,(H,24,27)