N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-ethyl-propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-ethyl-propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-ethyl-propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-ethylpropanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-ethylpropanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-ethyl-propionamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCCO2)C(=O)CCC3=C(N=C(N=C3C)SC)C

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCCO2)C(=O)CCC3=C(N=C(N=C3C)SC)C

InChI

InChI=1S/C21H27N3O3S/c1-5-24(13-16-6-8-18-19(12-16)27-11-10-26-18)20(25)9-7-17-14(2)22-21(28-4)23-15(17)3/h6,8,12H,5,7,9-11,13H2,1-4H3