N-[(E)-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]methylideneamino]-4-nitro-benzamide

Systemtic Name: N-[(E)-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]methylideneamino]-4-nitro-benzamide Openeye Name: N-[(E)-[5-(1H-benzimidazol-2-ylsulfanyl)-2-furyl]methyleneamino]-4-nitro-benzamide CAS Name: N-[(E)-[5-(1H-benzimidazol-2-ylthio)-2-furanyl]methylideneamino]-4-nitrobenzamide IUPAC Name: N-[(E)-[5-(1H-benzimidazol-2-ylsulfanyl)furan-2-yl]methylideneamino]-4-nitrobenzamide Traditional Name: N-[(E)-[5-(1H-benzimidazol-2-ylthio)-2-furyl]methyleneamino]-4-nitro-benzamide Formula: C19H13N5O4S MolecularWeight: 407.40262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SC3=CC=C(O3)C=NNC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SC3=CC=C(O3)/C=N/NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H13N5O4S/c25-18(12-5-7-13(8-6-12)24(26)27)23-20-11-14-9-10-17(28-14)29-19-21-15-3-1-2-4-16(15)22-19/h1-11H,(H,21,22)(H,23,25)/b20-11+