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

Systemtic Name: 3-[2-(pyrazin-2-ylamino)-5-pyrimidin-4-yl-1,3-thiazol-4-yl]benzenecarbonitrile Openeye Name: 3-[2-(pyrazin-2-ylamino)-5-pyrimidin-4-yl-thiazol-4-yl]benzonitrile CAS Name: 3-[2-(2-pyrazinylamino)-5-(4-pyrimidinyl)-4-thiazolyl]benzonitrile IUPAC Name: 3-[2-(pyrazin-2-ylamino)-5-pyrimidin-4-yl-1,3-thiazol-4-yl]benzonitrile Traditional Name: 3-[2-(pyrazin-2-ylamino)-5-(4-pyrimidyl)thiazol-4-yl]benzonitrile Formula: C18H11N7S MolecularWeight: 357.39184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C2=C(SC(=N2)NC3=NC=CN=C3)C4=NC=NC=C4)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C2=C(SC(=N2)NC3=NC=CN=C3)C4=NC=NC=C4)C#N

InChI

InChI=1S/C18H11N7S/c19-9-12-2-1-3-13(8-12)16-17(14-4-5-21-11-23-14)26-18(25-16)24-15-10-20-6-7-22-15/h1-8,10-11H,(H,22,24,25)