1,3-benzothiazol-2-ylmethyl-[(1R)-1-(4-bromophenyl)ethyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(1R)-1-(4-bromophenyl)ethyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(1R)-1-(4-bromophenyl)ethyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(1R)-1-(4-bromophenyl)ethyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(1R)-1-(4-bromophenyl)ethyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(1R)-1-(4-bromophenyl)ethyl]ammonium Formula: C16H16BrN2S+ MolecularWeight: 348.28064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrN2S/c1-11(12-6-8-13(17)9-7-12)18-10-16-19-14-4-2-3-5-15(14)20-16/h2-9,11,18H,10H2,1H3/p+1/t11-/m1/s1