[(2S)-1-(1,3-benzothiazol-2-ylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S)-1-(1,3-benzothiazol-2-ylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S)-1-(1,3-benzothiazol-2-ylcarbamoyl)-3-methyl-butyl]ammonium CAS Name: [(2S)-1-(1,3-benzothiazol-2-ylamino)-4-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S)-1-(1,3-benzothiazol-2-ylamino)-4-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S)-1-(1,3-benzothiazol-2-ylcarbamoyl)-3-methyl-butyl]ammonium Formula: C13H18N3OS+ MolecularWeight: 264.36652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=NC2=CC=CC=C2S1)[NH3+]

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1=NC2=CC=CC=C2S1)[NH3+]

InChI

InChI=1S/C13H17N3OS/c1-8(2)7-9(14)12(17)16-13-15-10-5-3-4-6-11(10)18-13/h3-6,8-9H,7,14H2,1-2H3,(H,15,16,17)/p+1/t9-/m0/s1