N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide

Systemtic Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide Openeye Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanamide CAS Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]propanamide IUPAC Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanamide Traditional Name: N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]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)NC(C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)N[C@H](C)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H23N3O3S/c1-11(14-5-7-16-17(9-14)25-10-24-16)20-18(23)8-6-15-12(2)21-19(26-4)22-13(15)3/h5,7,9,11H,6,8,10H2,1-4H3,(H,20,23)/t11-/m1/s1