1,3-benzothiazol-2-ylmethyl-[(1S)-1-(3-chlorophenyl)propyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(3-chlorophenyl)propyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(3-chlorophenyl)propyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(3-chlorophenyl)propyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(3-chlorophenyl)propyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(3-chlorophenyl)propyl]ammonium Formula: C17H18ClN2S+ MolecularWeight: 317.85622

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)Cl)[NH2+]CC2=NC3=CC=CC=C3S2

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClN2S/c1-2-14(12-6-5-7-13(18)10-12)19-11-17-20-15-8-3-4-9-16(15)21-17/h3-10,14,19H,2,11H2,1H3/p+1/t14-/m0/s1