3-acetamido-N-[(3-nitro-4-phenylsulfanyl-phenyl)methylideneamino]benzamide

Systemtic Name: 3-acetamido-N-[(3-nitro-4-phenylsulfanyl-phenyl)methylideneamino]benzamide Openeye Name: 3-acetamido-N-[(3-nitro-4-phenylsulfanyl-phenyl)methyleneamino]benzamide CAS Name: 3-acetamido-N-[[3-nitro-4-(phenylthio)phenyl]methylideneamino]benzamide IUPAC Name: 3-acetamido-N-[(3-nitro-4-phenylsulfanylphenyl)methylideneamino]benzamide Traditional Name: 3-acetamido-N-[[3-nitro-4-(phenylthio)benzylidene]amino]benzamide Formula: C22H18N4O4S MolecularWeight: 434.46772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)NN=CC2=CC(=C(C=C2)SC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)NN=CC2=CC(=C(C=C2)SC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O4S/c1-15(27)24-18-7-5-6-17(13-18)22(28)25-23-14-16-10-11-21(20(12-16)26(29)30)31-19-8-3-2-4-9-19/h2-14H,1H3,(H,24,27)(H,25,28)