[(2S)-1-[(6-chloranyl-1,3-benzothiazol-2-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S)-1-[(6-chloranyl-1,3-benzothiazol-2-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S)-1-[(6-chloro-1,3-benzothiazol-2-yl)carbamoyl]-3-methyl-butyl]ammonium CAS Name: [(2S)-1-[(6-chloro-1,3-benzothiazol-2-yl)amino]-4-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S)-1-[(6-chloro-1,3-benzothiazol-2-yl)amino]-4-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S)-1-[(6-chloro-1,3-benzothiazol-2-yl)carbamoyl]-3-methyl-butyl]ammonium Formula: C13H17ClN3OS+ MolecularWeight: 298.81158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)Cl)[NH3+]

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1=NC2=C(S1)C=C(C=C2)Cl)[NH3+]

InChI

InChI=1S/C13H16ClN3OS/c1-7(2)5-9(15)12(18)17-13-16-10-4-3-8(14)6-11(10)19-13/h3-4,6-7,9H,5,15H2,1-2H3,(H,16,17,18)/p+1/t9-/m0/s1