2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]pyridine-4-carbothioamide

Systemtic Name: 2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]pyridine-4-carbothioamide Openeye Name: 2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]pyridine-4-carbothioamide CAS Name: 2-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propylamino]-4-pyridinecarbothioamide IUPAC Name: 2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]pyridine-4-carbothioamide Traditional Name: 2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]thioisonicotinamide Formula: C15H25N4S+ MolecularWeight: 293.4508

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC2=NC=CC(=C2)C(=S)N

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC2=NC=CC(=C2)C(=S)N

InChI

InChI=1S/C15H24N4S/c1-12-5-2-3-9-19(12)10-4-7-17-14-11-13(15(16)20)6-8-18-14/h6,8,11-12H,2-5,7,9-10H2,1H3,(H2,16,20)(H,17,18)/p+1/t12-/m0/s1