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

Systemtic Name: 2-(benzimidazol-1-yl)-1-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 2-(benzimidazol-1-yl)-1-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]propan-1-one CAS Name: 2-(1-benzimidazolyl)-1-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(benzimidazol-1-yl)-1-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 2-(benzimidazol-1-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:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Br)N3C=NC4=CC=CC=C43

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Br)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C18H19BrN4O3S2/c1-13(23-12-20-14-4-2-3-5-15(14)23)18(24)21-8-10-22(11-9-21)28(25,26)17-7-6-16(19)27-17/h2-7,12-13H,8-11H2,1H3