N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-pyrimidinylthio)propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-pyrimidylthio)propionamide Formula: C15H15N3O3S MolecularWeight: 317.3629

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)CCSC3=NC=CC=N3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)CCSC3=NC=CC=N3

InChI

InChI=1S/C15H15N3O3S/c19-14(4-9-22-15-16-5-1-6-17-15)18-11-2-3-12-13(10-11)21-8-7-20-12/h1-3,5-6,10H,4,7-9H2,(H,18,19)