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1,3-benzothiazol-2-ylmethyl-[(1S)-1-(4-methylsulfanylphenyl)ethyl]azanium

1,3-benzothiazol-2-ylmethyl-[(1S)-1-(4-methylsulfanylphenyl)ethyl]azanium

Systemtic Name:1,3-benzothiazol-2-ylmethyl-[(1S)-1-(4-methylsulfanylphenyl)ethyl]azanium
Openeye Name:1,3-benzothiazol-2-ylmethyl-[(1S)-1-(4-methylsulfanylphenyl)ethyl]ammonium
CAS Name:1,3-benzothiazol-2-ylmethyl-[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonium
IUPAC Name:1,3-benzothiazol-2-ylmethyl-[(1S)-1-(4-methylsulfanylphenyl)ethyl]azanium
Traditional Name:1,3-benzothiazol-2-ylmethyl-[(1S)-1-[4-(methylthio)phenyl]ethyl]ammonium
Formula: C17H19N2S2+
MolecularWeight: 315.47616
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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)[NH2+]CC2=NC3=CC=CC=C3S2


Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)SC)[NH2+]CC2=NC3=CC=CC=C3S2


InChI

InChI=1S/C17H18N2S2/c1-12(13-7-9-14(20-2)10-8-13)18-11-17-19-15-5-3-4-6-16(15)21-17/h3-10,12,18H,11H2,1-2H3/p+1/t12-/m0/s1


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