3-[2-(1H-pyrazin-4-ylamino)-5-(1,2,4-triazol-1-yl)-1,3-thiazol-4-yl]benzenecarbonitrile

Systemtic Name: 3-[2-(1H-pyrazin-4-ylamino)-5-(1,2,4-triazol-1-yl)-1,3-thiazol-4-yl]benzenecarbonitrile Openeye Name: 3-[2-(1H-pyrazin-4-ylamino)-5-(1,2,4-triazol-1-yl)thiazol-4-yl]benzonitrile CAS Name: 3-[2-(1H-pyrazin-4-ylamino)-5-(1,2,4-triazol-1-yl)-4-thiazolyl]benzonitrile IUPAC Name: 3-[2-(1H-pyrazin-4-ylamino)-5-(1,2,4-triazol-1-yl)-1,3-thiazol-4-yl]benzonitrile Traditional Name: 3-[2-(1H-pyrazin-4-ylamino)-5-(1,2,4-triazol-1-yl)thiazol-4-yl]benzonitrile Formula: C16H12N8S MolecularWeight: 348.38508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=C(SC(=N2)NN3C=CNC=C3)N4C=NC=N4)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C2=C(SC(=N2)NN3C=CNC=C3)N4C=NC=N4)C#N

InChI

InChI=1S/C16H12N8S/c17-9-12-2-1-3-13(8-12)14-15(24-11-19-10-20-24)25-16(21-14)22-23-6-4-18-5-7-23/h1-8,10-11,18H,(H,21,22)