5-nitro-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]benzenecarbonitrile

Systemtic Name: 5-nitro-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]benzenecarbonitrile Openeye Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-5-nitro-benzonitrile CAS Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-5-nitrobenzonitrile IUPAC Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-5-nitrobenzonitrile Traditional Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-5-nitro-benzonitrile Formula: C15H9N5O2S2 MolecularWeight: 355.39426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H9N5O2S2/c16-9-10-8-12(20(21)22)6-7-13(10)23-15-19-18-14(24-15)17-11-4-2-1-3-5-11/h1-8H,(H,17,18)