N-[(E)-(3-nitro-4-quinolin-5-ylsulfanyl-phenyl)methylideneamino]-2-(9-oxidanylideneacridin-10-yl)ethanamide

Systemtic Name: N-[(E)-(3-nitro-4-quinolin-5-ylsulfanyl-phenyl)methylideneamino]-2-(9-oxidanylideneacridin-10-yl)ethanamide Openeye Name: N-[(E)-[3-nitro-4-(5-quinolylsulfanyl)phenyl]methyleneamino]-2-(9-oxoacridin-10-yl)acetamide CAS Name: N-[(E)-[3-nitro-4-(5-quinolinylthio)phenyl]methylideneamino]-2-(9-oxo-10-acridinyl)acetamide IUPAC Name: N-[(E)-(3-nitro-4-quinolin-5-ylsulfanylphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide Traditional Name: 2-(9-ketoacridin-10-yl)-N-[(E)-[3-nitro-4-(5-quinolylthio)benzylidene]amino]acetamide Formula: C31H21N5O4S MolecularWeight: 559.59454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N2CC(=O)NN=CC4=CC(=C(C=C4)SC5=CC=CC6=C5C=CC=N6)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N2CC(=O)N/N=C/C4=CC(=C(C=C4)SC5=CC=CC6=C5C=CC=N6)[N+](=O)[O-]

InChI

InChI=1S/C31H21N5O4S/c37-30(19-35-25-11-3-1-7-22(25)31(38)23-8-2-4-12-26(23)35)34-33-18-20-14-15-29(27(17-20)36(39)40)41-28-13-5-10-24-21(28)9-6-16-32-24/h1-18H,19H2,(H,34,37)/b33-18+