1-(1,3-benzothiazol-2-yl)-1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)piperidin-1-ium-4-carboxamide Openeye Name: 1-(1,3-benzothiazol-2-yl)-1-(5-isopropyl-1,3,4-thiadiazol-2-yl)piperidin-1-ium-4-carboxamide CAS Name: 1-(1,3-benzothiazol-2-yl)-1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(1,3-benzothiazol-2-yl)-1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(1,3-benzothiazol-2-yl)-1-(5-isopropyl-1,3,4-thiadiazol-2-yl)piperidin-1-ium-4-carboxamide Formula: C18H22N5OS2+ MolecularWeight: 388.53018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)[N+]2(CCC(CC2)C(=O)N)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)C1=NN=C(S1)[N+]2(CCC(CC2)C(=O)N)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H21N5OS2/c1-11(2)16-21-22-18(26-16)23(9-7-12(8-10-23)15(19)24)17-20-13-5-3-4-6-14(13)25-17/h3-6,11-12H,7-10H2,1-2H3,(H-,19,24)/p+1