N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-2-(3-methyl-4-propan-2-yl-phenoxy)ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-2-(3-methyl-4-propan-2-yl-phenoxy)ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-2-(4-isopropyl-3-methyl-phenoxy)acetamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-sulfanylidenemethyl]-2-(3-methyl-4-propan-2-ylphenoxy)acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-2-(3-methyl-4-propan-2-ylphenoxy)acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylthiocarbamoyl)-2-(4-isopropyl-3-methyl-phenoxy)acetamide Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC(=S)NC2=CC3=C(C=C2)OCCO3)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC(=S)NC2=CC3=C(C=C2)OCCO3)C(C)C

InChI

InChI=1S/C21H24N2O4S/c1-13(2)17-6-5-16(10-14(17)3)27-12-20(24)23-21(28)22-15-4-7-18-19(11-15)26-9-8-25-18/h4-7,10-11,13H,8-9,12H2,1-3H3,(H2,22,23,24,28)