4-[2-(5-bromanyl-2-methoxy-phenyl)ethanoylamino]-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]piperidine-4-carboxamide

Systemtic Name: 4-[2-(5-bromanyl-2-methoxy-phenyl)ethanoylamino]-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]piperidine-4-carboxamide Openeye Name: 4-[[2-(5-bromo-2-methoxy-phenyl)acetyl]amino]-N-[2-(p-tolylsulfonylamino)ethyl]piperidine-4-carboxamide CAS Name: 4-[[2-(5-bromo-2-methoxyphenyl)-1-oxoethyl]amino]-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-piperidinecarboxamide IUPAC Name: 4-[[2-(5-bromo-2-methoxyphenyl)acetyl]amino]-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]piperidine-4-carboxamide Traditional Name: 4-[[2-(5-bromo-2-methoxy-phenyl)acetyl]amino]-N-[2-(tosylamino)ethyl]isonipecotamide Formula: C24H31BrN4O5S MolecularWeight: 567.49574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCNC(=O)C2(CCNCC2)NC(=O)CC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCNC(=O)C2(CCNCC2)NC(=O)CC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C24H31BrN4O5S/c1-17-3-6-20(7-4-17)35(32,33)28-14-13-27-23(31)24(9-11-26-12-10-24)29-22(30)16-18-15-19(25)5-8-21(18)34-2/h3-8,15,26,28H,9-14,16H2,1-2H3,(H,27,31)(H,29,30)