N-(5-chloranyl-2-phenylsulfanyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-(5-chloranyl-2-phenylsulfanyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-(5-chloro-2-phenylsulfanyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[5-chloro-2-(phenylthio)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-(5-chloro-2-phenylsulfanylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[5-chloro-2-(phenylthio)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C21H16ClNO3S MolecularWeight: 397.87464

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NC3=C(C=CC(=C3)Cl)SC4=CC=CC=C4

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)C(=O)NC3=C(C=CC(=C3)Cl)SC4=CC=CC=C4

InChI

InChI=1S/C21H16ClNO3S/c22-14-10-11-20(27-15-6-2-1-3-7-15)16(12-14)23-21(24)19-13-25-17-8-4-5-9-18(17)26-19/h1-12,19H,13H2,(H,23,24)