N-(1,3-benzodioxol-5-ylmethyl)-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-methyl-propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-methylpropanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-methylpropanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-methyl-N-piperonyl-propionamide Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N(C)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N(C)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H23N3O3S/c1-12-15(13(2)21-19(20-12)26-4)6-8-18(23)22(3)10-14-5-7-16-17(9-14)25-11-24-16/h5,7,9H,6,8,10-11H2,1-4H3