2-[(4-chlorophenyl)carbamothioyl-ethyl-amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide

Systemtic Name: 2-[(4-chlorophenyl)carbamothioyl-ethyl-amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide Openeye Name: 2-[(4-chlorophenyl)carbamothioyl-ethyl-amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide CAS Name: 2-[[(4-chloroanilino)-sulfanylidenemethyl]-ethylamino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide IUPAC Name: 2-[(4-chlorophenyl)carbamothioyl-ethylamino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Traditional Name: 2-[(4-chlorophenyl)thiocarbamoyl-ethyl-amino]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Formula: C19H20ClN3O3S MolecularWeight: 405.8984

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20ClN3O3S/c1-2-23(19(27)22-14-5-3-13(20)4-6-14)12-18(24)21-15-7-8-16-17(11-15)26-10-9-25-16/h3-8,11H,2,9-10,12H2,1H3,(H,21,24)(H,22,27)