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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-methyl-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]-methyl-ammonium Formula: C20H20N3OS+ MolecularWeight: 350.4573

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+](C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C[NH+](C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19N3OS/c1-13-20(14-7-3-4-8-15(14)21-13)17(24)11-23(2)12-19-22-16-9-5-6-10-18(16)25-19/h3-10,21H,11-12H2,1-2H3/p+1