N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-2-methylsulfanyl-pyrimidine-5-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-2-methylsulfanyl-pyrimidine-5-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-2-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-2-(methylthio)-5-pyrimidinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-2-methylsulfanylpyrimidine-5-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-2-(methylthio)pyrimidine-5-carboxamide Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NC=C1C(=O)NC2=CC3=C(C=C2)OCCO3)SC

Isomeric SMILES

CCC1=NC(=NC=C1C(=O)NC2=CC3=C(C=C2)OCCO3)SC

InChI

InChI=1S/C16H17N3O3S/c1-3-12-11(9-17-16(19-12)23-2)15(20)18-10-4-5-13-14(8-10)22-7-6-21-13/h4-5,8-9H,3,6-7H2,1-2H3,(H,18,20)