N-cyclopropyl-2-[4-[[2-(4-ethylphenyl)-4-methyl-1,3-thiazol-5-yl]carbonyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[[2-(4-ethylphenyl)-4-methyl-1,3-thiazol-5-yl]carbonyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[2-(4-ethylphenyl)-4-methyl-thiazole-5-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[[2-(4-ethylphenyl)-4-methyl-5-thiazolyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[2-(4-ethylphenyl)-4-methyl-1,3-thiazole-5-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[2-(4-ethylphenyl)-4-methyl-thiazole-5-carbonyl]piperazin-1-ium-1-yl]acetamide Formula: C22H29N4O2S+ MolecularWeight: 413.55626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=C(S2)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=C(S2)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4)C

InChI

InChI=1S/C22H28N4O2S/c1-3-16-4-6-17(7-5-16)21-23-15(2)20(29-21)22(28)26-12-10-25(11-13-26)14-19(27)24-18-8-9-18/h4-7,18H,3,8-14H2,1-2H3,(H,24,27)/p+1