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

Systemtic Name: 2-[2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]ethanoylamino]-N,N,4-trimethyl-1,3-thiazole-5-carboxamide Openeye Name: 2-[[2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]-N,N,4-trimethyl-thiazole-5-carboxamide CAS Name: 2-[[2-[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]-N,N,4-trimethyl-5-thiazolecarboxamide IUPAC Name: 2-[[2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]-N,N,4-trimethyl-1,3-thiazole-5-carboxamide Traditional Name: 2-[[2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]acetyl]amino]-N,N,4-trimethyl-thiazole-5-carboxamide Formula: C20H28N5O3S+ MolecularWeight: 418.53302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N5O3S/c1-14-18(19(27)23(2)3)29-20(21-14)22-17(26)13-24-8-10-25(11-9-24)15-6-5-7-16(12-15)28-4/h5-7,12H,8-11,13H2,1-4H3,(H,21,22,26)/p+1