3-[[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-(2-methylphenyl)carbonyl-amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-(2-methylphenyl)carbonyl-amino]propyl-dimethyl-azanium Openeye Name: 3-[[2-[(4,5-dimethylthiazol-2-yl)amino]-2-oxo-ethyl]-(2-methylbenzoyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-[(4,5-dimethyl-2-thiazolyl)amino]-2-oxoethyl]-[(2-methylphenyl)-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-(2-methylbenzoyl)amino]propyl-dimethylazanium Traditional Name: 3-[[2-[(4,5-dimethylthiazol-2-yl)amino]-2-keto-ethyl]-o-toluoyl-amino]propyl-dimethyl-ammonium Formula: C20H29N4O2S+ MolecularWeight: 389.53486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N(CCC[NH+](C)C)CC(=O)NC2=NC(=C(S2)C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N(CCC[NH+](C)C)CC(=O)NC2=NC(=C(S2)C)C

InChI

InChI=1S/C20H28N4O2S/c1-14-9-6-7-10-17(14)19(26)24(12-8-11-23(4)5)13-18(25)22-20-21-15(2)16(3)27-20/h6-7,9-10H,8,11-13H2,1-5H3,(H,21,22,25)/p+1