N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-bromophenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-bromophenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-bromophenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-bromophenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(4-bromophenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-brosyl-piperazine-1-carboxamide Formula: C20H22BrN5O3S MolecularWeight: 492.38938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCCC2=NC3=CC=CC=C3N2)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1C(=O)NCCC2=NC3=CC=CC=C3N2)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H22BrN5O3S/c21-15-5-7-16(8-6-15)30(28,29)26-13-11-25(12-14-26)20(27)22-10-9-19-23-17-3-1-2-4-18(17)24-19/h1-8H,9-14H2,(H,22,27)(H,23,24)