N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-2-phenylsulfanyl-ethanamide Openeye Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-2-phenylsulfanyl-acetamide CAS Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-(phenylthio)acetamide IUPAC Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-phenylsulfanylacetamide Traditional Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-2-(phenylthio)acetamide Formula: C16H13BrN2O3S MolecularWeight: 393.25502

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)CSC3=CC=CC=C3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=N/NC(=O)CSC3=CC=CC=C3)Br

InChI

InChI=1S/C16H13BrN2O3S/c17-13-7-15-14(21-10-22-15)6-11(13)8-18-19-16(20)9-23-12-4-2-1-3-5-12/h1-8H,9-10H2,(H,19,20)/b18-8+