N-(4-methoxyphenyl)-4-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-amine

Systemtic Name: N-(4-methoxyphenyl)-4-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-amine Openeye Name: N-(4-methoxyphenyl)-4-[[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]methyl]thiazol-2-amine CAS Name: N-(4-methoxyphenyl)-4-[(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)methyl]-2-thiazolamine IUPAC Name: N-(4-methoxyphenyl)-4-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-amine Traditional Name: (4-methoxyphenyl)-[4-[[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]methyl]thiazol-2-yl]amine Formula: C19H23N4O3S3+ MolecularWeight: 451.60592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=CS2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=CS2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H22N4O3S3/c1-26-17-6-4-15(5-7-17)20-19-21-16(14-28-19)13-22-8-10-23(11-9-22)29(24,25)18-3-2-12-27-18/h2-7,12,14H,8-11,13H2,1H3,(H,20,21)/p+1