N-[5-[[(3S)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-ium-1-yl]methyl]thiophen-2-yl]ethanamide

Systemtic Name: N-[5-[[(3S)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-ium-1-yl]methyl]thiophen-2-yl]ethanamide Openeye Name: N-[5-[[(3S)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-ium-1-yl]methyl]-2-thienyl]acetamide CAS Name: N-[5-[[(3S)-3-(4-methyl-1H-pyrazol-5-yl)-1-piperidin-1-iumyl]methyl]-2-thiophenyl]acetamide IUPAC Name: N-[5-[[(3S)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-ium-1-yl]methyl]thiophen-2-yl]acetamide Traditional Name: N-[5-[[(3S)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-ium-1-yl]methyl]-2-thienyl]acetamide Formula: C16H23N4OS+ MolecularWeight: 319.44502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NN=C1)C2CCC[NH+](C2)CC3=CC=C(S3)NC(=O)C

Isomeric SMILES

CC1=C(NN=C1)[C@H]2CCC[NH+](C2)CC3=CC=C(S3)NC(=O)C

InChI

InChI=1S/C16H22N4OS/c1-11-8-17-19-16(11)13-4-3-7-20(9-13)10-14-5-6-15(22-14)18-12(2)21/h5-6,8,13H,3-4,7,9-10H2,1-2H3,(H,17,19)(H,18,21)/p+1/t13-/m0/s1