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

Systemtic Name: 3-(cyclohexylcarbamoylamino)-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]propanamide Openeye Name: 3-(cyclohexylcarbamoylamino)-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]propanamide CAS Name: 3-[[(cyclohexylamino)-oxomethyl]amino]-N-[4-[(4-methyl-1-piperidin-1-iumyl)methyl]-2-thiazolyl]propanamide IUPAC Name: 3-(cyclohexylcarbamoylamino)-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]propanamide Traditional Name: 3-(cyclohexylcarbamoylamino)-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]propionamide Formula: C20H34N5O2S+ MolecularWeight: 408.58126

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)CCNC(=O)NC3CCCCC3

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)CCNC(=O)NC3CCCCC3

InChI

InChI=1S/C20H33N5O2S/c1-15-8-11-25(12-9-15)13-17-14-28-20(23-17)24-18(26)7-10-21-19(27)22-16-5-3-2-4-6-16/h14-16H,2-13H2,1H3,(H2,21,22,27)(H,23,24,26)/p+1