(4-propan-2-ylpiperazin-4-ium-1-yl)-thiophen-2-yl-methanone

Systemtic Name: (4-propan-2-ylpiperazin-4-ium-1-yl)-thiophen-2-yl-methanone Openeye Name: (4-isopropylpiperazin-4-ium-1-yl)-(2-thienyl)methanone CAS Name: (4-propan-2-yl-1-piperazin-4-iumyl)-thiophen-2-ylmethanone IUPAC Name: (4-propan-2-ylpiperazin-4-ium-1-yl)-thiophen-2-ylmethanone Traditional Name: (4-isopropylpiperazin-4-ium-1-yl)-(2-thienyl)methanone Formula: C12H19N2OS+ MolecularWeight: 239.35706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)C(=O)C2=CC=CS2

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)C(=O)C2=CC=CS2

InChI

InChI=1S/C12H18N2OS/c1-10(2)13-5-7-14(8-6-13)12(15)11-4-3-9-16-11/h3-4,9-10H,5-8H2,1-2H3/p+1