N-[(3-phenylmethoxyphenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[(3-phenylmethoxyphenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[(3-benzyloxyphenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[(3-phenylmethoxyanilino)-sulfanylidenemethyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[(3-phenylmethoxyphenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[(3-benzoxyphenyl)thiocarbamoyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NC(=S)NC3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)C(=O)NC(=S)NC3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H20N2O4S/c26-22(21-15-28-19-11-4-5-12-20(19)29-21)25-23(30)24-17-9-6-10-18(13-17)27-14-16-7-2-1-3-8-16/h1-13,21H,14-15H2,(H2,24,25,26,30)