cyclopropyl-[4-[[3-(2-methylpropyl)-2-sulfanylidene-benzimidazol-1-yl]methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: cyclopropyl-[4-[[3-(2-methylpropyl)-2-sulfanylidene-benzimidazol-1-yl]methyl]piperazin-4-ium-1-yl]methanone Openeye Name: cyclopropyl-[4-[(3-isobutyl-2-thioxo-benzimidazol-1-yl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: cyclopropyl-[4-[[3-(2-methylpropyl)-2-sulfanylidene-1-benzimidazolyl]methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: cyclopropyl-[4-[[3-(2-methylpropyl)-2-sulfanylidenebenzimidazol-1-yl]methyl]piperazin-4-ium-1-yl]methanone Traditional Name: cyclopropyl-[4-[(3-isobutyl-2-thioxo-benzimidazol-1-yl)methyl]piperazin-4-ium-1-yl]methanone Formula: C20H29N4OS+ MolecularWeight: 373.53546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N(C1=S)C[NH+]3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2N(C1=S)C[NH+]3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C20H28N4OS/c1-15(2)13-23-17-5-3-4-6-18(17)24(20(23)26)14-21-9-11-22(12-10-21)19(25)16-7-8-16/h3-6,15-16H,7-14H2,1-2H3/p+1