N-cyclopropyl-4-(pyridin-4-ylmethyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: N-cyclopropyl-4-(pyridin-4-ylmethyl)piperazin-4-ium-1-carbothioamide Openeye Name: N-cyclopropyl-4-(4-pyridylmethyl)piperazin-4-ium-1-carbothioamide CAS Name: N-cyclopropyl-4-(pyridin-4-ylmethyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: N-cyclopropyl-4-(pyridin-4-ylmethyl)piperazin-4-ium-1-carbothioamide Traditional Name: N-cyclopropyl-4-(4-pyridylmethyl)piperazin-4-ium-1-carbothioamide Formula: C14H21N4S+ MolecularWeight: 277.40834

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=S)N2CC[NH+](CC2)CC3=CC=NC=C3

Isomeric SMILES

C1CC1NC(=S)N2CC[NH+](CC2)CC3=CC=NC=C3

InChI

InChI=1S/C14H20N4S/c19-14(16-13-1-2-13)18-9-7-17(8-10-18)11-12-3-5-15-6-4-12/h3-6,13H,1-2,7-11H2,(H,16,19)/p+1