1,3-benzothiazol-2-ylmethyl-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[2-[(2-cyclopentyl-3-pyrazolyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C19H24N5OS+ MolecularWeight: 370.49176

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=CC=NN3C4CCCC4

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=CC=NN3C4CCCC4

InChI

InChI=1S/C19H23N5OS/c1-23(13-19-21-15-8-4-5-9-16(15)26-19)12-18(25)22-17-10-11-20-24(17)14-6-2-3-7-14/h4-5,8-11,14H,2-3,6-7,12-13H2,1H3,(H,22,25)/p+1