3-[5-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1,3-thiazol-2-yl]hexanenitrile

Systemtic Name: 3-[5-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1,3-thiazol-2-yl]hexanenitrile Openeye Name: 3-[5-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)thiazol-2-yl]hexanenitrile CAS Name: 3-[5-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-2-thiazolyl]hexanenitrile IUPAC Name: 3-[5-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1,3-thiazol-2-yl]hexanenitrile Traditional Name: 3-[5-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)thiazol-2-yl]hexanenitrile Formula: C15H15N5S MolecularWeight: 297.3781

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC#N)C1=NC=C(S1)C2=C3C=CNC3=NC=N2

Isomeric SMILES

CCCC(CC#N)C1=NC=C(S1)C2=C3C=CNC3=NC=N2

InChI

InChI=1S/C15H15N5S/c1-2-3-10(4-6-16)15-18-8-12(21-15)13-11-5-7-17-14(11)20-9-19-13/h5,7-10H,2-4H2,1H3,(H,17,19,20)