[(2S)-1-(1,3-benzothiazol-2-ylamino)-1-oxidanylidene-propan-2-yl]-(1,3-benzothiazol-2-ylmethyl)-methyl-azanium

Systemtic Name: [(2S)-1-(1,3-benzothiazol-2-ylamino)-1-oxidanylidene-propan-2-yl]-(1,3-benzothiazol-2-ylmethyl)-methyl-azanium Openeye Name: [(1S)-2-(1,3-benzothiazol-2-ylamino)-1-methyl-2-oxo-ethyl]-(1,3-benzothiazol-2-ylmethyl)-methyl-ammonium CAS Name: [(2S)-1-(1,3-benzothiazol-2-ylamino)-1-oxopropan-2-yl]-(1,3-benzothiazol-2-ylmethyl)-methylammonium IUPAC Name: [(2S)-1-(1,3-benzothiazol-2-ylamino)-1-oxopropan-2-yl]-(1,3-benzothiazol-2-ylmethyl)-methylazanium Traditional Name: [(1S)-2-(1,3-benzothiazol-2-ylamino)-2-keto-1-methyl-ethyl]-(1,3-benzothiazol-2-ylmethyl)-methyl-ammonium Formula: C19H19N4OS2+ MolecularWeight: 383.51036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=CC=CC=C2S1)[NH+](C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C[C@@H](C(=O)NC1=NC2=CC=CC=C2S1)[NH+](C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H18N4OS2/c1-12(18(24)22-19-21-14-8-4-6-10-16(14)26-19)23(2)11-17-20-13-7-3-5-9-15(13)25-17/h3-10,12H,11H2,1-2H3,(H,21,22,24)/p+1/t12-/m0/s1