N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]-3-phenyl-thiophene-2-carboxamide

Systemtic Name: N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]-3-phenyl-thiophene-2-carboxamide Openeye Name: N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]-3-phenyl-thiophene-2-carboxamide CAS Name: N-[4-[(4-methyl-1-piperidin-1-iumyl)methyl]-2-thiazolyl]-3-phenyl-2-thiophenecarboxamide IUPAC Name: N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]-3-phenylthiophene-2-carboxamide Traditional Name: N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]-3-phenyl-thiophene-2-carboxamide Formula: C21H24N3OS2+ MolecularWeight: 398.56476

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)C3=C(C=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)C3=C(C=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3OS2/c1-15-7-10-24(11-8-15)13-17-14-27-21(22-17)23-20(25)19-18(9-12-26-19)16-5-3-2-4-6-16/h2-6,9,12,14-15H,7-8,10-11,13H2,1H3,(H,22,23,25)/p+1