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

Systemtic Name: N,N,4-trimethyl-2-[2-(4-phenylpiperazin-1-ium-1-yl)ethanoylamino]-1,3-thiazole-5-carboxamide Openeye Name: N,N,4-trimethyl-2-[[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]amino]thiazole-5-carboxamide CAS Name: N,N,4-trimethyl-2-[[1-oxo-2-(4-phenyl-1-piperazin-1-iumyl)ethyl]amino]-5-thiazolecarboxamide IUPAC Name: N,N,4-trimethyl-2-[[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]amino]-1,3-thiazole-5-carboxamide Traditional Name: N,N,4-trimethyl-2-[[2-(4-phenylpiperazin-1-ium-1-yl)acetyl]amino]thiazole-5-carboxamide Formula: C19H26N5O2S+ MolecularWeight: 388.50704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N5O2S/c1-14-17(18(26)22(2)3)27-19(20-14)21-16(25)13-23-9-11-24(12-10-23)15-7-5-4-6-8-15/h4-8H,9-13H2,1-3H3,(H,20,21,25)/p+1