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

Systemtic Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-thiophen-3-yl-1,3-thiazole-4-carboxamide Openeye Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(3-thienyl)thiazole-4-carboxamide CAS Name: N-[3-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-(3-thiophenyl)-4-thiazolecarboxamide IUPAC Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-thiophen-3-yl-1,3-thiazole-4-carboxamide Traditional Name: N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(3-thienyl)thiazole-4-carboxamide Formula: C20H23N4OS2+ MolecularWeight: 399.55282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CSC(=N2)C3=CSC=C3)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CSC(=N2)C3=CSC=C3)N4CC[NH+](CC4)C

InChI

InChI=1S/C20H22N4OS2/c1-14-11-16(3-4-18(14)24-8-6-23(2)7-9-24)21-19(25)17-13-27-20(22-17)15-5-10-26-12-15/h3-5,10-13H,6-9H2,1-2H3,(H,21,25)/p+1