N-(1,3-benzothiazol-2-ylmethyl)-1-propan-2-yl-piperidin-1-ium-4-amine

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-propan-2-yl-piperidin-1-ium-4-amine Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-isopropyl-piperidin-1-ium-4-amine CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-propan-2-yl-4-piperidin-1-iumamine IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-propan-2-ylpiperidin-1-ium-4-amine Traditional Name: 1,3-benzothiazol-2-ylmethyl-(1-isopropylpiperidin-1-ium-4-yl)amine Formula: C16H24N3S+ MolecularWeight: 290.44686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H23N3S/c1-12(2)19-9-7-13(8-10-19)17-11-16-18-14-5-3-4-6-15(14)20-16/h3-6,12-13,17H,7-11H2,1-2H3/p+1