3-[2-azanyl-5-(1,2,4-triazol-1-yl)-1,3-thiazol-4-yl]benzenecarbonitrile

Systemtic Name: 3-[2-azanyl-5-(1,2,4-triazol-1-yl)-1,3-thiazol-4-yl]benzenecarbonitrile Openeye Name: 3-[2-amino-5-(1,2,4-triazol-1-yl)thiazol-4-yl]benzonitrile CAS Name: 3-[2-amino-5-(1,2,4-triazol-1-yl)-4-thiazolyl]benzonitrile IUPAC Name: 3-[2-amino-5-(1,2,4-triazol-1-yl)-1,3-thiazol-4-yl]benzonitrile Traditional Name: 3-[2-amino-5-(1,2,4-triazol-1-yl)thiazol-4-yl]benzonitrile Formula: C12H8N6S MolecularWeight: 268.29712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=C(SC(=N2)N)N3C=NC=N3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C2=C(SC(=N2)N)N3C=NC=N3)C#N

InChI

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