2-(1,3-benzothiazol-2-yl)-2-(2,4-dinitrophenyl)imino-ethanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-(2,4-dinitrophenyl)imino-ethanenitrile Openeye Name: N-(2,4-dinitrophenyl)-1,3-benzothiazole-2-carboximidoyl cyanide CAS Name: 2-(1,3-benzothiazol-2-yl)-2-(2,4-dinitrophenyl)iminoacetonitrile IUPAC Name: N-(2,4-dinitrophenyl)-1,3-benzothiazole-2-carboximidoyl cyanide Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-(2,4-dinitrophenyl)imino-acetonitrile Formula: C15H7N5O4S MolecularWeight: 353.31218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(=NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C#N

InChI

InChI=1S/C15H7N5O4S/c16-8-12(15-18-11-3-1-2-4-14(11)25-15)17-10-6-5-9(19(21)22)7-13(10)20(23)24/h1-7H