4-(5-bromanylthiophen-2-yl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]butanamide

Systemtic Name: 4-(5-bromanylthiophen-2-yl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]butanamide Openeye Name: 4-(5-bromo-2-thienyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]butanamide CAS Name: 4-(5-bromo-2-thiophenyl)-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]butanamide IUPAC Name: 4-(5-bromothiophen-2-yl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]butanamide Traditional Name: 4-(5-bromo-2-thienyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]butyramide Formula: C18H24BrN4OS+ MolecularWeight: 424.37836

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)CCCC3=CC=C(S3)Br

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)CCCC3=CC=C(S3)Br

InChI

InChI=1S/C18H23BrN4OS/c1-22-9-11-23(12-10-22)17-8-5-14(13-20-17)21-18(24)4-2-3-15-6-7-16(19)25-15/h5-8,13H,2-4,9-12H2,1H3,(H,21,24)/p+1