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1,3-benzothiazol-2-ylmethyl-methyl-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]azanium

1,3-benzothiazol-2-ylmethyl-methyl-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]azanium

Systemtic Name:1,3-benzothiazol-2-ylmethyl-methyl-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]azanium
Openeye Name:1,3-benzothiazol-2-ylmethyl-[2-(benzylamino)-2-oxo-ethyl]-methyl-ammonium
CAS Name:1,3-benzothiazol-2-ylmethyl-methyl-[2-oxo-2-[(phenylmethyl)amino]ethyl]ammonium
IUPAC Name:1,3-benzothiazol-2-ylmethyl-[2-(benzylamino)-2-oxoethyl]-methylazanium
Traditional Name:1,3-benzothiazol-2-ylmethyl-[2-(benzylamino)-2-keto-ethyl]-methyl-ammonium
Formula: C18H20N3OS+
MolecularWeight: 326.4359
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NCC3=CC=CC=C3


Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NCC3=CC=CC=C3


InChI

InChI=1S/C18H19N3OS/c1-21(12-17(22)19-11-14-7-3-2-4-8-14)13-18-20-15-9-5-6-10-16(15)23-18/h2-10H,11-13H2,1H3,(H,19,22)/p+1


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