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

Systemtic Name: dimethyl-[3-[[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-naphthalen-2-ylcarbonyl-amino]propyl]azanium Openeye Name: dimethyl-[3-[[2-[(4-methylthiazol-2-yl)amino]-2-oxo-ethyl]-(naphthalene-2-carbonyl)amino]propyl]ammonium CAS Name: dimethyl-[3-[[2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl]-[2-naphthalenyl(oxo)methyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-(naphthalene-2-carbonyl)amino]propyl]azanium Traditional Name: 3-[[2-keto-2-[(4-methylthiazol-2-yl)amino]ethyl]-(2-naphthoyl)amino]propyl-dimethyl-ammonium Formula: C22H27N4O2S+ MolecularWeight: 411.54038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CN(CCC[NH+](C)C)C(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CN(CCC[NH+](C)C)C(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H26N4O2S/c1-16-15-29-22(23-16)24-20(27)14-26(12-6-11-25(2)3)21(28)19-10-9-17-7-4-5-8-18(17)13-19/h4-5,7-10,13,15H,6,11-12,14H2,1-3H3,(H,23,24,27)/p+1