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

Systemtic Name: [(2S,3S)-1-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2S)-1-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3S)-1-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-1-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]-2-methyl-butyl]ammonium Formula: C14H20N3O2S+ MolecularWeight: 294.3925

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O2S/c1-4-8(2)12(15)13(18)17-14-16-10-6-5-9(19-3)7-11(10)20-14/h5-8,12H,4,15H2,1-3H3,(H,16,17,18)/p+1/t8-,12-/m0/s1