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

Systemtic Name: N-(4-methoxyphenyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-amine Openeye Name: N-(4-methoxyphenyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]thiazol-2-amine CAS Name: N-(4-methoxyphenyl)-4-[(4-phenyl-1-piperazin-1-iumyl)methyl]-2-thiazolamine IUPAC Name: N-(4-methoxyphenyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1,3-thiazol-2-amine Traditional Name: (4-methoxyphenyl)-[4-[(4-phenylpiperazin-1-ium-1-yl)methyl]thiazol-2-yl]amine Formula: C21H25N4OS+ MolecularWeight: 381.5144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4OS/c1-26-20-9-7-17(8-10-20)22-21-23-18(16-27-21)15-24-11-13-25(14-12-24)19-5-3-2-4-6-19/h2-10,16H,11-15H2,1H3,(H,22,23)/p+1