[4-methyl-2-(4-methylphenyl)-1,3-thiazol-5-yl]-[4-(2-pyridin-4-ylethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [4-methyl-2-(4-methylphenyl)-1,3-thiazol-5-yl]-[4-(2-pyridin-4-ylethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [4-methyl-2-(p-tolyl)thiazol-5-yl]-[4-[2-(4-pyridyl)ethyl]piperazin-4-ium-1-yl]methanone CAS Name: [4-methyl-2-(4-methylphenyl)-5-thiazolyl]-[4-(2-pyridin-4-ylethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [4-methyl-2-(4-methylphenyl)-1,3-thiazol-5-yl]-[4-(2-pyridin-4-ylethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [4-methyl-2-(p-tolyl)thiazol-5-yl]-[4-[2-(4-pyridyl)ethyl]piperazin-4-ium-1-yl]methanone Formula: C23H27N4OS+ MolecularWeight: 407.55168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(S2)C(=O)N3CC[NH+](CC3)CCC4=CC=NC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(S2)C(=O)N3CC[NH+](CC3)CCC4=CC=NC=C4)C

InChI

InChI=1S/C23H26N4OS/c1-17-3-5-20(6-4-17)22-25-18(2)21(29-22)23(28)27-15-13-26(14-16-27)12-9-19-7-10-24-11-8-19/h3-8,10-11H,9,12-16H2,1-2H3/p+1