N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[(2-ethyl-6-methylphenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[(2-ethyl-6-methyl-phenyl)thiocarbamoyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NC(=O)C2=CC3=C(C=C2)OCCO3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NC(=O)C2=CC3=C(C=C2)OCCO3)C

InChI

InChI=1S/C19H20N2O3S/c1-3-13-6-4-5-12(2)17(13)20-19(25)21-18(22)14-7-8-15-16(11-14)24-10-9-23-15/h4-8,11H,3,9-10H2,1-2H3,(H2,20,21,22,25)