2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2,5-dimethylpyrazol-3-yl)ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2,5-dimethylpyrazol-3-yl)ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(2,5-dimethyl-3-pyrazolyl)acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(2,5-dimethylpyrazol-3-yl)acetamide Formula: C15H17N3O3S MolecularWeight: 319.37878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSC2=CC3=C(C=C2)OCCO3)C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSC2=CC3=C(C=C2)OCCO3)C

InChI

InChI=1S/C15H17N3O3S/c1-10-7-14(18(2)17-10)16-15(19)9-22-11-3-4-12-13(8-11)21-6-5-20-12/h3-4,7-8H,5-6,9H2,1-2H3,(H,16,19)