N,N,4-trimethyl-2-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanoylamino]-1,3-thiazole-5-carboxamide

Systemtic Name: N,N,4-trimethyl-2-[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanoylamino]-1,3-thiazole-5-carboxamide Openeye Name: N,N,4-trimethyl-2-[[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetyl]amino]thiazole-5-carboxamide CAS Name: N,N,4-trimethyl-2-[[1-oxo-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]ethyl]amino]-5-thiazolecarboxamide IUPAC Name: N,N,4-trimethyl-2-[[2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetyl]amino]-1,3-thiazole-5-carboxamide Traditional Name: N,N,4-trimethyl-2-[[2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]acetyl]amino]thiazole-5-carboxamide Formula: C17H24N7O2S+ MolecularWeight: 390.48316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C[NH+]2CCN(CC2)C3=NC=CC=N3)C(=O)N(C)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C[NH+]2CCN(CC2)C3=NC=CC=N3)C(=O)N(C)C

InChI

InChI=1S/C17H23N7O2S/c1-12-14(15(26)22(2)3)27-17(20-12)21-13(25)11-23-7-9-24(10-8-23)16-18-5-4-6-19-16/h4-6H,7-11H2,1-3H3,(H,20,21,25)/p+1