2-(3-oxidanylidenepiperazin-1-ium-1-yl)-N-[4-(2,4,6-trimethylphenyl)-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-(3-oxidanylidenepiperazin-1-ium-1-yl)-N-[4-(2,4,6-trimethylphenyl)-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(3-oxopiperazin-1-ium-1-yl)-N-[4-(2,4,6-trimethylphenyl)thiazol-2-yl]acetamide CAS Name: 2-(3-oxo-1-piperazin-1-iumyl)-N-[4-(2,4,6-trimethylphenyl)-2-thiazolyl]acetamide IUPAC Name: 2-(3-oxopiperazin-1-ium-1-yl)-N-[4-(2,4,6-trimethylphenyl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(3-ketopiperazin-1-ium-1-yl)-N-(4-mesitylthiazol-2-yl)acetamide Formula: C18H23N4O2S+ MolecularWeight: 359.46582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=CSC(=N2)NC(=O)C[NH+]3CCNC(=O)C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=CSC(=N2)NC(=O)C[NH+]3CCNC(=O)C3)C

InChI

InChI=1S/C18H22N4O2S/c1-11-6-12(2)17(13(3)7-11)14-10-25-18(20-14)21-16(24)9-22-5-4-19-15(23)8-22/h6-7,10H,4-5,8-9H2,1-3H3,(H,19,23)(H,20,21,24)/p+1