3-azanyl-N-[4-(3-methylbutanoylamino)phenyl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[4-(3-methylbutanoylamino)phenyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[4-(3-methylbutanoylamino)phenyl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[4-(3-methylbutanoylamino)phenyl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-[4-(isovalerylamino)phenyl]pyrazinamide Formula: C16H19N5O2 MolecularWeight: 313.35436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=NC=CN=C2N

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=NC=CN=C2N

InChI

InChI=1S/C16H19N5O2/c1-10(2)9-13(22)20-11-3-5-12(6-4-11)21-16(23)14-15(17)19-8-7-18-14/h3-8,10H,9H2,1-2H3,(H2,17,19)(H,20,22)(H,21,23)