N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-2-(8-quinolylsulfanyl)acetamide CAS Name: N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-(8-quinolinylthio)acetamide IUPAC Name: N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-[(Z)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-2-(8-quinolylthio)acetamide Formula: C19H14N4O5S MolecularWeight: 410.40326

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)CSC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=N\NC(=O)CSC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H14N4O5S/c24-18(10-29-17-5-1-3-12-4-2-6-20-19(12)17)22-21-9-13-7-15-16(28-11-27-15)8-14(13)23(25)26/h1-9H,10-11H2,(H,22,24)/b21-9-