2-[4-[2-[4-(phenylsulfonyl)phenyl]ethyl]piperazin-1-yl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[4-[2-[4-(phenylsulfonyl)phenyl]ethyl]piperazin-1-yl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[4-[2-[4-(benzenesulfonyl)phenyl]ethyl]piperazin-1-yl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[4-[2-[4-(benzenesulfonyl)phenyl]ethyl]-1-piperazinyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[4-[2-[4-(benzenesulfonyl)phenyl]ethyl]piperazin-1-yl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[4-[2-(4-besylphenyl)ethyl]piperazino]-1H-benzimidazole-4-carboxamide Formula: C26H27N5O3S MolecularWeight: 489.58928

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3)C4=NC5=C(C=CC=C5N4)C(=O)N

Isomeric SMILES

C1CN(CCN1CCC2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3)C4=NC5=C(C=CC=C5N4)C(=O)N

InChI

InChI=1S/C26H27N5O3S/c27-25(32)22-7-4-8-23-24(22)29-26(28-23)31-17-15-30(16-18-31)14-13-19-9-11-21(12-10-19)35(33,34)20-5-2-1-3-6-20/h1-12H,13-18H2,(H2,27,32)(H,28,29)