3-azanyl-N-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[(4-isopentyloxy-3-methoxy-phenyl)methyl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-(4-isoamoxy-3-methoxy-benzyl)pyrazinamide Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)CNC(=O)C2=NC=CN=C2N)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)CNC(=O)C2=NC=CN=C2N)OC

InChI

InChI=1S/C18H24N4O3/c1-12(2)6-9-25-14-5-4-13(10-15(14)24-3)11-22-18(23)16-17(19)21-8-7-20-16/h4-5,7-8,10,12H,6,9,11H2,1-3H3,(H2,19,21)(H,22,23)