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1,3-benzothiazol-2-ylmethyl-[(1R)-1,2-diphenylethyl]azanium

1,3-benzothiazol-2-ylmethyl-[(1R)-1,2-diphenylethyl]azanium

Systemtic Name:1,3-benzothiazol-2-ylmethyl-[(1R)-1,2-diphenylethyl]azanium
Openeye Name:1,3-benzothiazol-2-ylmethyl-[(1R)-1,2-diphenylethyl]ammonium
CAS Name:1,3-benzothiazol-2-ylmethyl-[(1R)-1,2-diphenylethyl]ammonium
IUPAC Name:1,3-benzothiazol-2-ylmethyl-[(1R)-1,2-diphenylethyl]azanium
Traditional Name:1,3-benzothiazol-2-ylmethyl-[(1R)-1,2-diphenylethyl]ammonium
Formula: C22H21N2S+
MolecularWeight: 345.48054
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=CC=CC=C2)[NH2+]CC3=NC4=CC=CC=C4S3


Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C2=CC=CC=C2)[NH2+]CC3=NC4=CC=CC=C4S3


InChI

InChI=1S/C22H20N2S/c1-3-9-17(10-4-1)15-20(18-11-5-2-6-12-18)23-16-22-24-19-13-7-8-14-21(19)25-22/h1-14,20,23H,15-16H2/p+1/t20-/m1/s1


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