3-(1H-benzimidazol-2-ylsulfanyl)-6-nitro-4-phenyl-1H-quinolin-2-one

Systemtic Name: 3-(1H-benzimidazol-2-ylsulfanyl)-6-nitro-4-phenyl-1H-quinolin-2-one Openeye Name: 3-(1H-benzimidazol-2-ylsulfanyl)-6-nitro-4-phenyl-1H-quinolin-2-one CAS Name: 3-(1H-benzimidazol-2-ylthio)-6-nitro-4-phenyl-1H-quinolin-2-one IUPAC Name: 3-(1H-benzimidazol-2-ylsulfanyl)-6-nitro-4-phenyl-1H-quinolin-2-one Traditional Name: 3-(1H-benzimidazol-2-ylthio)-6-nitro-4-phenyl-carbostyril Formula: C22H14N4O3S MolecularWeight: 414.43656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)[N+](=O)[O-])SC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)[N+](=O)[O-])SC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C22H14N4O3S/c27-21-20(30-22-24-17-8-4-5-9-18(17)25-22)19(13-6-2-1-3-7-13)15-12-14(26(28)29)10-11-16(15)23-21/h1-12H,(H,23,27)(H,24,25)