N-(2-morpholin-4-ium-4-ylethyl)-N-[3-oxidanylidene-3-[[(1R)-1-phenylethyl]amino]propyl]pyrazine-2-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[3-oxidanylidene-3-[[(1R)-1-phenylethyl]amino]propyl]pyrazine-2-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[3-oxo-3-[[(1R)-1-phenylethyl]amino]propyl]pyrazine-2-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-N-[3-oxo-3-[[(1R)-1-phenylethyl]amino]propyl]-2-pyrazinecarboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[3-oxo-3-[[(1R)-1-phenylethyl]amino]propyl]pyrazine-2-carboxamide Traditional Name: N-[3-keto-3-[[(1R)-1-phenylethyl]amino]propyl]-N-(2-morpholin-4-ium-4-ylethyl)pyrazinamide Formula: C22H30N5O3+ MolecularWeight: 412.5053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CCN(CC[NH+]2CCOCC2)C(=O)C3=NC=CN=C3

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)CCN(CC[NH+]2CCOCC2)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C22H29N5O3/c1-18(19-5-3-2-4-6-19)25-21(28)7-10-27(12-11-26-13-15-30-16-14-26)22(29)20-17-23-8-9-24-20/h2-6,8-9,17-18H,7,10-16H2,1H3,(H,25,28)/p+1/t18-/m1/s1