[2-[(2,6-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl-(3-propan-2-yloxypropyl)azanium

Systemtic Name: [2-[(2,6-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl-(3-propan-2-yloxypropyl)azanium Openeye Name: [2-(N-acetyl-2,6-dimethyl-anilino)thiazol-4-yl]methyl-(3-isopropoxypropyl)ammonium CAS Name: [2-(N-acetyl-2,6-dimethylanilino)-4-thiazolyl]methyl-(3-propan-2-yloxypropyl)ammonium IUPAC Name: [2-(N-acetyl-2,6-dimethylanilino)-1,3-thiazol-4-yl]methyl-(3-propan-2-yloxypropyl)azanium Traditional Name: [2-(N-acetyl-2,6-dimethyl-anilino)thiazol-4-yl]methyl-(3-isopropoxypropyl)ammonium Formula: C20H30N3O2S+ MolecularWeight: 376.5361

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N(C2=NC(=CS2)C[NH2+]CCCOC(C)C)C(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N(C2=NC(=CS2)C[NH2+]CCCOC(C)C)C(=O)C

InChI

InChI=1S/C20H29N3O2S/c1-14(2)25-11-7-10-21-12-18-13-26-20(22-18)23(17(5)24)19-15(3)8-6-9-16(19)4/h6,8-9,13-14,21H,7,10-12H2,1-5H3/p+1