N-(1,3-benzodioxol-5-yl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(4,5,6-trimethylpyrimidin-2-yl)thio]acetamide Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC(=O)NC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC(=O)NC2=CC3=C(C=C2)OCO3)C

InChI

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