dimethyl-[2-[[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-naphthalen-1-ylcarbonyl-amino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-naphthalen-1-ylcarbonyl-amino]ethyl]azanium Openeye Name: dimethyl-[2-[[2-[(4-methylthiazol-2-yl)amino]-2-oxo-ethyl]-(naphthalene-1-carbonyl)amino]ethyl]ammonium CAS Name: dimethyl-[2-[[2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl]-[1-naphthalenyl(oxo)methyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-(naphthalene-1-carbonyl)amino]ethyl]azanium Traditional Name: 2-[[2-keto-2-[(4-methylthiazol-2-yl)amino]ethyl]-(1-naphthoyl)amino]ethyl-dimethyl-ammonium Formula: C21H25N4O2S+ MolecularWeight: 397.5138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CN(CC[NH+](C)C)C(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CN(CC[NH+](C)C)C(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H24N4O2S/c1-15-14-28-21(22-15)23-19(26)13-25(12-11-24(2)3)20(27)18-10-6-8-16-7-4-5-9-17(16)18/h4-10,14H,11-13H2,1-3H3,(H,22,23,26)/p+1