5-[(4-bromophenyl)sulfonylmethyl]-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]furan-2-carboxamide

Systemtic Name: 5-[(4-bromophenyl)sulfonylmethyl]-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]furan-2-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-5-[(4-bromophenyl)sulfonylmethyl]furan-2-carboxamide CAS Name: 5-[(4-bromophenyl)sulfonylmethyl]-N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-2-furancarboxamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-5-[(4-bromophenyl)sulfonylmethyl]furan-2-carboxamide Traditional Name: N-[2-(4-benzylpiperazino)ethyl]-5-(brosylmethyl)-2-furamide Formula: C25H28BrN3O4S MolecularWeight: 546.47652

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=C(C=C3)Br)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=C(C=C3)Br)CC4=CC=CC=C4

InChI

InChI=1S/C25H28BrN3O4S/c26-21-6-9-23(10-7-21)34(31,32)19-22-8-11-24(33-22)25(30)27-12-13-28-14-16-29(17-15-28)18-20-4-2-1-3-5-20/h1-11H,12-19H2,(H,27,30)