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

Systemtic Name: N-methyl-2-[(2R)-1-[(4-methylphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(pyrazin-2-ylmethyl)ethanamide Openeye Name: N-methyl-2-[(2R)-3-oxo-1-(p-tolylmethyl)piperazin-1-ium-2-yl]-N-(pyrazin-2-ylmethyl)acetamide CAS Name: N-methyl-2-[(2R)-1-[(4-methylphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-(2-pyrazinylmethyl)acetamide IUPAC Name: N-methyl-2-[(2R)-1-[(4-methylphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(pyrazin-2-ylmethyl)acetamide Traditional Name: 2-[(2R)-3-keto-1-(4-methylbenzyl)piperazin-1-ium-2-yl]-N-methyl-N-(pyrazin-2-ylmethyl)acetamide Formula: C20H26N5O2+ MolecularWeight: 368.45274

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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=CN=C3

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCNC(=O)[C@H]2CC(=O)N(C)CC3=NC=CN=C3

InChI

InChI=1S/C20H25N5O2/c1-15-3-5-16(6-4-15)13-25-10-9-23-20(27)18(25)11-19(26)24(2)14-17-12-21-7-8-22-17/h3-8,12,18H,9-11,13-14H2,1-2H3,(H,23,27)/p+1/t18-/m1/s1