5-azanyl-2-phenylazanyl-1,3,4-thiadiazepine-6,7-dicarbonitrile

Systemtic Name: 5-azanyl-2-phenylazanyl-1,3,4-thiadiazepine-6,7-dicarbonitrile Openeye Name: 5-amino-2-anilino-1,3,4-thiadiazepine-6,7-dicarbonitrile CAS Name: 5-amino-2-anilino-1,3,4-thiadiazepine-6,7-dicarbonitrile IUPAC Name: 5-amino-2-anilino-1,3,4-thiadiazepine-6,7-dicarbonitrile Traditional Name: 5-amino-2-anilino-1,3,4-thiadiazepine-6,7-dicarbonitrile Formula: C12H8N6S MolecularWeight: 268.29712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NN=C(C(=C(S2)C#N)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NN=C(C(=C(S2)C#N)C#N)N

InChI

InChI=1S/C12H8N6S/c13-6-9-10(7-14)19-12(18-17-11(9)15)16-8-4-2-1-3-5-8/h1-5H,(H2,15,17)(H,16,18)