N-[3-(butylamino)-3-oxidanylidene-propyl]-5-methyl-N-phenethyl-pyrazine-2-carboxamide

Systemtic Name: N-[3-(butylamino)-3-oxidanylidene-propyl]-5-methyl-N-phenethyl-pyrazine-2-carboxamide Openeye Name: N-[3-(butylamino)-3-oxo-propyl]-5-methyl-N-phenethyl-pyrazine-2-carboxamide CAS Name: N-[3-(butylamino)-3-oxopropyl]-5-methyl-N-phenethyl-2-pyrazinecarboxamide IUPAC Name: N-[3-(butylamino)-3-oxopropyl]-5-methyl-N-phenethylpyrazine-2-carboxamide Traditional Name: N-[3-(butylamino)-3-keto-propyl]-5-methyl-N-phenethyl-pyrazinamide Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CCN(CCC1=CC=CC=C1)C(=O)C2=CN=C(C=N2)C

Isomeric SMILES

CCCCNC(=O)CCN(CCC1=CC=CC=C1)C(=O)C2=CN=C(C=N2)C

InChI

InChI=1S/C21H28N4O2/c1-3-4-12-22-20(26)11-14-25(13-10-18-8-6-5-7-9-18)21(27)19-16-23-17(2)15-24-19/h5-9,15-16H,3-4,10-14H2,1-2H3,(H,22,26)