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

Systemtic Name: N-(2-cyclopentylpyrazol-3-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanamide Openeye Name: N-(2-cyclopentylpyrazol-3-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetamide IUPAC Name: N-(2-cyclopentylpyrazol-3-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetamide Traditional Name: N-(2-cyclopentylpyrazol-3-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CC=N2)NC(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCC(C1)N2C(=CC=N2)NC(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C18H21N3O3S/c22-18(20-17-7-8-19-21(17)13-3-1-2-4-13)12-25-14-5-6-15-16(11-14)24-10-9-23-15/h5-8,11,13H,1-4,9-10,12H2,(H,20,22)