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

Systemtic Name: [(2R)-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1R)-1-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]-3-methylsulfonyl-propyl]ammonium CAS Name: [(2R)-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-methylsulfonyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2R)-1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-methylsulfonyl-1-oxobutan-2-yl]azanium Traditional Name: [(1R)-3-mesyl-1-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]propyl]ammonium Formula: C13H18N3O3S2+ MolecularWeight: 328.43032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CCS(=O)(=O)C)[NH3+]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)[C@@H](CCS(=O)(=O)C)[NH3+]

InChI

InChI=1S/C13H17N3O3S2/c1-8-3-4-10-11(7-8)20-13(15-10)16-12(17)9(14)5-6-21(2,18)19/h3-4,7,9H,5-6,14H2,1-2H3,(H,15,16,17)/p+1/t9-/m1/s1