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

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CSC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CSC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H19N3O3S/c1-10-16(11(2)19(3)18-10)17-15(20)9-23-12-4-5-13-14(8-12)22-7-6-21-13/h4-5,8H,6-7,9H2,1-3H3,(H,17,20)