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

Systemtic Name: 4-(3-bromophenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]piperazine-1-carboxamide Openeye Name: 4-(3-bromophenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]piperazine-1-carboxamide CAS Name: 4-(3-bromophenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]-1-piperazinecarboxamide IUPAC Name: 4-(3-bromophenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]piperazine-1-carboxamide Traditional Name: 4-(3-bromophenyl)sulfonyl-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(=CC=C3)Br

Isomeric SMILES

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

InChI

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