N-methyl-2-[(2R)-1-[(4-methylphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(1,3-thiazol-2-ylmethyl)ethanamide

Systemtic Name: N-methyl-2-[(2R)-1-[(4-methylphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(1,3-thiazol-2-ylmethyl)ethanamide Openeye Name: N-methyl-2-[(2R)-3-oxo-1-(p-tolylmethyl)piperazin-1-ium-2-yl]-N-(thiazol-2-ylmethyl)acetamide CAS Name: N-methyl-2-[(2R)-1-[(4-methylphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-(2-thiazolylmethyl)acetamide IUPAC Name: N-methyl-2-[(2R)-1-[(4-methylphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(1,3-thiazol-2-ylmethyl)acetamide Traditional Name: 2-[(2R)-3-keto-1-(4-methylbenzyl)piperazin-1-ium-2-yl]-N-methyl-N-(thiazol-2-ylmethyl)acetamide Formula: C19H25N4O2S+ MolecularWeight: 373.4924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCNC(=O)C2CC(=O)N(C)CC3=NC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCNC(=O)[C@H]2CC(=O)N(C)CC3=NC=CS3

InChI

InChI=1S/C19H24N4O2S/c1-14-3-5-15(6-4-14)12-23-9-7-21-19(25)16(23)11-18(24)22(2)13-17-20-8-10-26-17/h3-6,8,10,16H,7,9,11-13H2,1-2H3,(H,21,25)/p+1/t16-/m1/s1