N-(1,3-benzothiazol-2-ylimino)-N'-[(3-nitrophenyl)amino]benzenecarboximidamide

Systemtic Name: N-(1,3-benzothiazol-2-ylimino)-N'-[(3-nitrophenyl)amino]benzenecarboximidamide Openeye Name: N-(1,3-benzothiazol-2-ylimino)-N'-(3-nitroanilino)benzamidine CAS Name: N-(1,3-benzothiazol-2-ylimino)-N'-(3-nitroanilino)benzenecarboximidamide IUPAC Name: N-(1,3-benzothiazol-2-ylimino)-N'-(3-nitroanilino)benzenecarboximidamide Traditional Name: N-(1,3-benzothiazol-2-ylimino)-N'-(3-nitroanilino)benzamidine Formula: C20H14N6O2S MolecularWeight: 402.42916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=NNC2=CC(=CC=C2)[N+](=O)[O-])N=NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)/C(=N\NC2=CC(=CC=C2)[N+](=O)[O-])/N=NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H14N6O2S/c27-26(28)16-10-6-9-15(13-16)22-23-19(14-7-2-1-3-8-14)24-25-20-21-17-11-4-5-12-18(17)29-20/h1-13,22H/b23-19+,25-24?