dimethyl-[2-[3-[(5-methylpyrazin-2-yl)carbonyl-propyl-amino]propanoyl-(phenylmethyl)amino]ethyl]azanium

Systemtic Name: dimethyl-[2-[3-[(5-methylpyrazin-2-yl)carbonyl-propyl-amino]propanoyl-(phenylmethyl)amino]ethyl]azanium Openeye Name: 2-[benzyl-[3-[(5-methylpyrazine-2-carbonyl)-propyl-amino]propanoyl]amino]ethyl-dimethyl-ammonium CAS Name: dimethyl-[2-[[3-[[(5-methyl-2-pyrazinyl)-oxomethyl]-propylamino]-1-oxopropyl]-(phenylmethyl)amino]ethyl]ammonium IUPAC Name: 2-[benzyl-[3-[(5-methylpyrazine-2-carbonyl)-propylamino]propanoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[benzyl-[3-[(5-methylpyrazinoyl)-propyl-amino]propanoyl]amino]ethyl-dimethyl-ammonium Formula: C23H34N5O2+ MolecularWeight: 412.54836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC(=O)N(CC[NH+](C)C)CC1=CC=CC=C1)C(=O)C2=CN=C(C=N2)C

Isomeric SMILES

CCCN(CCC(=O)N(CC[NH+](C)C)CC1=CC=CC=C1)C(=O)C2=CN=C(C=N2)C

InChI

InChI=1S/C23H33N5O2/c1-5-12-27(23(30)21-17-24-19(2)16-25-21)13-11-22(29)28(15-14-26(3)4)18-20-9-7-6-8-10-20/h6-10,16-17H,5,11-15,18H2,1-4H3/p+1