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

Systemtic Name: N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]-1-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-(isoxazol-3-ylmethyl)-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-(3-isoxazolylmethyl)-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]-1-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(isoxazol-3-ylmethyl)-N-[3-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]piperidin-1-ium-4-carboxamide Formula: C19H22N5O2S+ MolecularWeight: 384.47528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)C2=CC(=CC=C2)NC(=O)C3CC[NH+](CC3)CC4=NOC=C4

Isomeric SMILES

CC1=NN=C(S1)C2=CC(=CC=C2)NC(=O)C3CC[NH+](CC3)CC4=NOC=C4

InChI

InChI=1S/C19H21N5O2S/c1-13-21-22-19(27-13)15-3-2-4-16(11-15)20-18(25)14-5-8-24(9-6-14)12-17-7-10-26-23-17/h2-4,7,10-11,14H,5-6,8-9,12H2,1H3,(H,20,25)/p+1