3-(1,3-benzodioxol-5-yl)-N-[2-[(5-cyanopyridin-2-yl)amino]ethyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(5-cyanopyridin-2-yl)amino]ethyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(5-cyano-2-pyridyl)amino]ethyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(5-cyano-2-pyridinyl)amino]ethyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(5-cyanopyridin-2-yl)amino]ethyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(5-cyano-2-pyridyl)amino]ethyl]propionamide Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)NCCNC3=NC=C(C=C3)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)NCCNC3=NC=C(C=C3)C#N

InChI

InChI=1S/C18H18N4O3/c19-10-14-2-5-17(22-11-14)20-7-8-21-18(23)6-3-13-1-4-15-16(9-13)25-12-24-15/h1-2,4-5,9,11H,3,6-8,12H2,(H,20,22)(H,21,23)