N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4,5-dimethylthiazol-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4,5-dimethyl-2-thiazolyl)-2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4,5-dimethylthiazol-2-yl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]acetamide Formula: C18H25N4O2S+ MolecularWeight: 361.4817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C18H24N4O2S/c1-13-14(2)25-18(19-13)20-17(23)12-21-8-10-22(11-9-21)15-4-6-16(24-3)7-5-15/h4-7H,8-12H2,1-3H3,(H,19,20,23)/p+1