1,3-benzothiazol-2-ylmethyl-[(1S)-1-(2,5-dimethylthiophen-3-yl)ethyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(2,5-dimethylthiophen-3-yl)ethyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(2,5-dimethyl-3-thienyl)ethyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(2,5-dimethyl-3-thiophenyl)ethyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(2,5-dimethylthiophen-3-yl)ethyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1-(2,5-dimethyl-3-thienyl)ethyl]ammonium Formula: C16H19N2S2+ MolecularWeight: 303.46546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(C)[NH2+]CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=C(S1)C)[C@H](C)[NH2+]CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H18N2S2/c1-10-8-13(12(3)19-10)11(2)17-9-16-18-14-6-4-5-7-15(14)20-16/h4-8,11,17H,9H2,1-3H3/p+1/t11-/m0/s1