N-(2-chlorophenyl)-3-[1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-(2-chlorophenyl)-3-[1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-(2-chlorophenyl)-3-[1-[(4-isopropylthiazol-2-yl)methyl]piperidin-1-ium-4-yl]propanamide CAS Name: N-(2-chlorophenyl)-3-[1-[(4-propan-2-yl-2-thiazolyl)methyl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(2-chlorophenyl)-3-[1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-(2-chlorophenyl)-3-[1-[(4-isopropylthiazol-2-yl)methyl]piperidin-1-ium-4-yl]propionamide Formula: C21H29ClN3OS+ MolecularWeight: 406.99246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CSC(=N1)C[NH+]2CCC(CC2)CCC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

CC(C)C1=CSC(=N1)C[NH+]2CCC(CC2)CCC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C21H28ClN3OS/c1-15(2)19-14-27-21(24-19)13-25-11-9-16(10-12-25)7-8-20(26)23-18-6-4-3-5-17(18)22/h3-6,14-16H,7-13H2,1-2H3,(H,23,26)/p+1