2-[dicyano-[(phenylmethyl)amino]methyl]-2H-1,3,4-thiadiazole-5,5-dicarbonitrile

Systemtic Name: 2-[dicyano-[(phenylmethyl)amino]methyl]-2H-1,3,4-thiadiazole-5,5-dicarbonitrile Openeye Name: 2-[(benzylamino)-dicyano-methyl]-2H-1,3,4-thiadiazole-5,5-dicarbonitrile CAS Name: 2-[dicyano-[(phenylmethyl)amino]methyl]-2H-1,3,4-thiadiazole-5,5-dicarbonitrile IUPAC Name: 2-[(benzylamino)-dicyanomethyl]-2H-1,3,4-thiadiazole-5,5-dicarbonitrile Traditional Name: 2-[(benzylamino)-dicyano-methyl]-2H-1,3,4-thiadiazole-5,5-dicarbonitrile Formula: C14H9N7S MolecularWeight: 307.33316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(C#N)(C#N)C2N=NC(S2)(C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC(C#N)(C#N)C2N=NC(S2)(C#N)C#N

InChI

InChI=1S/C14H9N7S/c15-7-13(8-16,19-6-11-4-2-1-3-5-11)12-20-21-14(9-17,10-18)22-12/h1-5,12,19H,6H2