N-[(2S)-butan-2-yl]-N-[3-oxidanylidene-3-[[(2R)-4-phenylbutan-2-yl]amino]propyl]pyrazine-2-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-N-[3-oxidanylidene-3-[[(2R)-4-phenylbutan-2-yl]amino]propyl]pyrazine-2-carboxamide Openeye Name: N-[3-[[(1R)-1-methyl-3-phenyl-propyl]amino]-3-oxo-propyl]-N-[(1S)-1-methylpropyl]pyrazine-2-carboxamide CAS Name: N-[(2S)-butan-2-yl]-N-[3-oxo-3-[[(2R)-4-phenylbutan-2-yl]amino]propyl]-2-pyrazinecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-N-[3-oxo-3-[[(2R)-4-phenylbutan-2-yl]amino]propyl]pyrazine-2-carboxamide Traditional Name: N-[3-keto-3-[[(1R)-1-methyl-3-phenyl-propyl]amino]propyl]-N-[(1S)-1-methylpropyl]pyrazinamide Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CCC(=O)NC(C)CCC1=CC=CC=C1)C(=O)C2=NC=CN=C2

Isomeric SMILES

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

InChI

InChI=1S/C22H30N4O2/c1-4-18(3)26(22(28)20-16-23-13-14-24-20)15-12-21(27)25-17(2)10-11-19-8-6-5-7-9-19/h5-9,13-14,16-18H,4,10-12,15H2,1-3H3,(H,25,27)/t17-,18+/m1/s1