2-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)-N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]ethanamide

Systemtic Name: 2-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)-N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]ethanamide Openeye Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-(4-methyl-2-oxo-thiazol-3-yl)acetamide CAS Name: 2-(4-methyl-2-oxo-3-thiazolyl)-N-[4-[4-(phenylmethyl)-1-piperazin-4-iumyl]phenyl]acetamide IUPAC Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide Traditional Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]-2-(2-keto-4-methyl-4-thiazolin-3-yl)acetamide Formula: C23H27N4O2S+ MolecularWeight: 423.55108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=O)N1CC(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CSC(=O)N1CC(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2S/c1-18-17-30-23(29)27(18)16-22(28)24-20-7-9-21(10-8-20)26-13-11-25(12-14-26)15-19-5-3-2-4-6-19/h2-10,17H,11-16H2,1H3,(H,24,28)/p+1