N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-4-propan-2-yl-benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-4-propan-2-yl-benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-4-isopropyl-benzamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-4-propan-2-ylbenzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylthiocarbamoyl)-4-isopropyl-benzamide Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O3S/c1-12(2)13-3-5-14(6-4-13)18(22)21-19(25)20-15-7-8-16-17(11-15)24-10-9-23-16/h3-8,11-12H,9-10H2,1-2H3,(H2,20,21,22,25)