N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-phenyl-1,3-thiazole-4-carboxamide

Systemtic Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-phenyl-1,3-thiazole-4-carboxamide Openeye Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-phenyl-thiazole-4-carboxamide CAS Name: N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-phenyl-4-thiazolecarboxamide IUPAC Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-phenyl-1,3-thiazole-4-carboxamide Traditional Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-phenyl-thiazole-4-carboxamide Formula: C22H25N4OS+ MolecularWeight: 393.5251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4OS/c1-16-14-18(26-12-10-25(2)11-13-26)8-9-19(16)23-21(27)20-15-28-22(24-20)17-6-4-3-5-7-17/h3-9,14-15H,10-13H2,1-2H3,(H,23,27)/p+1