1,3-benzothiazol-2-ylmethyl-[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[2-(cyclohexylcarbamoylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[2-[[(cyclohexylamino)-oxomethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[2-(cyclohexylcarbamoylamino)-2-oxoethyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-(cyclohexylcarbamoylamino)-2-keto-ethyl]-methyl-ammonium Formula: C18H25N4O2S+ MolecularWeight: 361.4817

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC(=O)NC3CCCCC3

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC(=O)NC3CCCCC3

InChI

InChI=1S/C18H24N4O2S/c1-22(12-17-20-14-9-5-6-10-15(14)25-17)11-16(23)21-18(24)19-13-7-3-2-4-8-13/h5-6,9-10,13H,2-4,7-8,11-12H2,1H3,(H2,19,21,23,24)/p+1