4-(4-bromophenyl)sulfonyl-N-[(6-methoxypyridin-3-yl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-bromophenyl)sulfonyl-N-[(6-methoxypyridin-3-yl)methyl]piperazine-1-carboxamide Openeye Name: 4-(4-bromophenyl)sulfonyl-N-[(6-methoxy-3-pyridyl)methyl]piperazine-1-carboxamide CAS Name: 4-(4-bromophenyl)sulfonyl-N-[(6-methoxy-3-pyridinyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-bromophenyl)sulfonyl-N-[(6-methoxypyridin-3-yl)methyl]piperazine-1-carboxamide Traditional Name: 4-brosyl-N-[(6-methoxy-3-pyridyl)methyl]piperazine-1-carboxamide Formula: C18H21BrN4O4S MolecularWeight: 469.35274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)CNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=NC=C(C=C1)CNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H21BrN4O4S/c1-27-17-7-2-14(12-20-17)13-21-18(24)22-8-10-23(11-9-22)28(25,26)16-5-3-15(19)4-6-16/h2-7,12H,8-11,13H2,1H3,(H,21,24)