2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylacetamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCC4)C

InChI

InChI=1S/C19H21N3O3S/c1-12-9-13(2)21-18(20-12)26-11-17(23)22-14-5-6-15-16(10-14)25-19(24-15)7-3-4-8-19/h5-6,9-10H,3-4,7-8,11H2,1-2H3,(H,22,23)