5-nitro-2-[[4-(1,3-thiazol-2-yl)phenyl]amino]benzenecarbonitrile

Systemtic Name: 5-nitro-2-[[4-(1,3-thiazol-2-yl)phenyl]amino]benzenecarbonitrile Openeye Name: 5-nitro-2-(4-thiazol-2-ylanilino)benzonitrile CAS Name: 5-nitro-2-[4-(2-thiazolyl)anilino]benzonitrile IUPAC Name: 5-nitro-2-[4-(1,3-thiazol-2-yl)anilino]benzonitrile Traditional Name: 5-nitro-2-(4-thiazol-2-ylanilino)benzonitrile Formula: C16H10N4O2S MolecularWeight: 322.3412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC=CS2)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC=C1C2=NC=CS2)NC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H10N4O2S/c17-10-12-9-14(20(21)22)5-6-15(12)19-13-3-1-11(2-4-13)16-18-7-8-23-16/h1-9,19H