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

Systemtic Name: [2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxidanylidene-ethyl]-methyl-(naphthalen-2-ylmethyl)azanium Openeye Name: [2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxo-ethyl]-methyl-(2-naphthylmethyl)ammonium CAS Name: [2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxoethyl]-methyl-(2-naphthalenylmethyl)ammonium IUPAC Name: [2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-oxoethyl]-methyl-(naphthalen-2-ylmethyl)azanium Traditional Name: [2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-2-keto-ethyl]-methyl-(2-naphthylmethyl)ammonium Formula: C23H24N3OS+ MolecularWeight: 390.52116

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=CC=CC=C2C=C1)CC(=O)N(C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C[NH+](CC1=CC2=CC=CC=C2C=C1)CC(=O)N(C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H23N3OS/c1-25(14-17-11-12-18-7-3-4-8-19(18)13-17)16-23(27)26(2)15-22-24-20-9-5-6-10-21(20)28-22/h3-13H,14-16H2,1-2H3/p+1