3-(2,2-dimethylpropanoylamino)-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: 3-(2,2-dimethylpropanoylamino)-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]benzamide Openeye Name: 3-(2,2-dimethylpropanoylamino)-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]benzamide CAS Name: 3-[(2,2-dimethyl-1-oxopropyl)amino]-N-[4-[(4-methyl-1-piperidin-1-iumyl)methyl]-2-thiazolyl]benzamide IUPAC Name: 3-(2,2-dimethylpropanoylamino)-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]benzamide Traditional Name: N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]-3-(pivaloylamino)benzamide Formula: C22H31N4O2S+ MolecularWeight: 415.57214

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)C3=CC(=CC=C3)NC(=O)C(C)(C)C

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)C3=CC(=CC=C3)NC(=O)C(C)(C)C

InChI

InChI=1S/C22H30N4O2S/c1-15-8-10-26(11-9-15)13-18-14-29-21(24-18)25-19(27)16-6-5-7-17(12-16)23-20(28)22(2,3)4/h5-7,12,14-15H,8-11,13H2,1-4H3,(H,23,28)(H,24,25,27)/p+1