3-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[5-(2-pyridyl)-1H-1,2,4-triazol-3-yl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[5-(2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[5-(2-pyridyl)-1H-1,2,4-triazol-3-yl]propionamide Formula: C17H15N5O3 MolecularWeight: 337.3327

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)NC3=NNC(=N3)C4=CC=CC=N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)NC3=NNC(=N3)C4=CC=CC=N4

InChI

InChI=1S/C17H15N5O3/c23-15(7-5-11-4-6-13-14(9-11)25-10-24-13)19-17-20-16(21-22-17)12-3-1-2-8-18-12/h1-4,6,8-9H,5,7,10H2,(H2,19,20,21,22,23)