4-(4-bromophenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-bromophenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]piperazine-1-carboxamide Openeye Name: 4-(4-bromophenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]piperazine-1-carboxamide CAS Name: 4-(4-bromophenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-bromophenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]piperazine-1-carboxamide Traditional Name: 4-brosyl-N-[2-(3-methylphenoxy)ethyl]piperazine-1-carboxamide Formula: C20H24BrN3O4S MolecularWeight: 482.39126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H24BrN3O4S/c1-16-3-2-4-18(15-16)28-14-9-22-20(25)23-10-12-24(13-11-23)29(26,27)19-7-5-17(21)6-8-19/h2-8,15H,9-14H2,1H3,(H,22,25)