N-[3-[[(2S)-3-methylbutan-2-yl]amino]-3-oxidanylidene-propyl]-N-phenethyl-pyrazine-2-carboxamide

Systemtic Name: N-[3-[[(2S)-3-methylbutan-2-yl]amino]-3-oxidanylidene-propyl]-N-phenethyl-pyrazine-2-carboxamide Openeye Name: N-[3-[[(1S)-1,2-dimethylpropyl]amino]-3-oxo-propyl]-N-phenethyl-pyrazine-2-carboxamide CAS Name: N-[3-[[(2S)-3-methylbutan-2-yl]amino]-3-oxopropyl]-N-phenethyl-2-pyrazinecarboxamide IUPAC Name: N-[3-[[(2S)-3-methylbutan-2-yl]amino]-3-oxopropyl]-N-phenethylpyrazine-2-carboxamide Traditional Name: N-[3-[[(1S)-1,2-dimethylpropyl]amino]-3-keto-propyl]-N-phenethyl-pyrazinamide Formula: C21H28N4O2 MolecularWeight: 368.47262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)CCN(CCC1=CC=CC=C1)C(=O)C2=NC=CN=C2

Isomeric SMILES

C[C@@H](C(C)C)NC(=O)CCN(CCC1=CC=CC=C1)C(=O)C2=NC=CN=C2

InChI

InChI=1S/C21H28N4O2/c1-16(2)17(3)24-20(26)10-14-25(13-9-18-7-5-4-6-8-18)21(27)19-15-22-11-12-23-19/h4-8,11-12,15-17H,9-10,13-14H2,1-3H3,(H,24,26)/t17-/m0/s1