(2S)-2-(1,3-benzodioxol-5-yloxy)-N-(4-methylpyrimidin-2-yl)butanamide

Systemtic Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-N-(4-methylpyrimidin-2-yl)butanamide Openeye Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-N-(4-methylpyrimidin-2-yl)butanamide CAS Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-N-(4-methyl-2-pyrimidinyl)butanamide IUPAC Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-N-(4-methylpyrimidin-2-yl)butanamide Traditional Name: (2S)-2-(1,3-benzodioxol-5-yloxy)-N-(4-methylpyrimidin-2-yl)butyramide Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC=CC(=N1)C)OC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC[C@@H](C(=O)NC1=NC=CC(=N1)C)OC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H17N3O4/c1-3-12(15(20)19-16-17-7-6-10(2)18-16)23-11-4-5-13-14(8-11)22-9-21-13/h4-8,12H,3,9H2,1-2H3,(H,17,18,19,20)/t12-/m0/s1