3-(1H-benzimidazol-2-yl)-1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(1H-benzimidazol-2-yl)-1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(1H-benzimidazol-2-yl)-1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]propan-1-one CAS Name: 3-(1H-benzimidazol-2-yl)-1-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(1H-benzimidazol-2-yl)-1-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(1H-benzimidazol-2-yl)-1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazino]propan-1-one Formula: C18H19BrN4O3S2 MolecularWeight: 483.40246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=NC3=CC=CC=C3N2)S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=NC3=CC=CC=C3N2)S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C18H19BrN4O3S2/c19-15-5-8-18(27-15)28(25,26)23-11-9-22(10-12-23)17(24)7-6-16-20-13-3-1-2-4-14(13)21-16/h1-5,8H,6-7,9-12H2,(H,20,21)