1-(3-methylbut-2-enyl)-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-(3-methylbut-2-enyl)-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-(3-methylbut-2-enyl)-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-(3-methylbut-2-enyl)-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(3-methylbut-2-enyl)-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(3-methylbut-2-enyl)-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-1-ium-4-carboxamide Formula: C20H27N4OS+ MolecularWeight: 371.51958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)C2=CC(=CC=C2)NC(=O)C3CC[NH+](CC3)CC=C(C)C

Isomeric SMILES

CC1=NN=C(S1)C2=CC(=CC=C2)NC(=O)C3CC[NH+](CC3)CC=C(C)C

InChI

InChI=1S/C20H26N4OS/c1-14(2)7-10-24-11-8-16(9-12-24)19(25)21-18-6-4-5-17(13-18)20-23-22-15(3)26-20/h4-7,13,16H,8-12H2,1-3H3,(H,21,25)/p+1