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

Systemtic Name: [(2S)-1-[(6-chloranyl-1,3-benzothiazol-2-yl)amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[(6-chloro-1,3-benzothiazol-2-yl)carbamoyl]-3-methylsulfonyl-propyl]ammonium CAS Name: [(2S)-1-[(6-chloro-1,3-benzothiazol-2-yl)amino]-4-methylsulfonyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-[(6-chloro-1,3-benzothiazol-2-yl)amino]-4-methylsulfonyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[(6-chloro-1,3-benzothiazol-2-yl)carbamoyl]-3-mesyl-propyl]ammonium Formula: C12H15ClN3O3S2+ MolecularWeight: 348.8488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClN3O3S2/c1-21(18,19)5-4-8(14)11(17)16-12-15-9-3-2-7(13)6-10(9)20-12/h2-3,6,8H,4-5,14H2,1H3,(H,15,16,17)/p+1/t8-/m0/s1