1-(5-phenyl-2-pyridin-2-yl-thieno[2,3-d]pyrimidin-4-yl)-1,2,4-triazole-3-carbonitrile

Systemtic Name: 1-(5-phenyl-2-pyridin-2-yl-thieno[2,3-d]pyrimidin-4-yl)-1,2,4-triazole-3-carbonitrile Openeye Name: 1-[5-phenyl-2-(2-pyridyl)thieno[2,3-d]pyrimidin-4-yl]-1,2,4-triazole-3-carbonitrile CAS Name: 1-[5-phenyl-2-(2-pyridinyl)-4-thieno[2,3-d]pyrimidinyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 1-(5-phenyl-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-1,2,4-triazole-3-carbonitrile Traditional Name: 1-[5-phenyl-2-(2-pyridyl)thieno[2,3-d]pyrimidin-4-yl]-1,2,4-triazole-3-carbonitrile Formula: C20H11N7S MolecularWeight: 381.41324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=NC(=NC(=C23)N4C=NC(=N4)C#N)C5=CC=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=NC(=NC(=C23)N4C=NC(=N4)C#N)C5=CC=CC=N5

InChI

InChI=1S/C20H11N7S/c21-10-16-23-12-27(26-16)19-17-14(13-6-2-1-3-7-13)11-28-20(17)25-18(24-19)15-8-4-5-9-22-15/h1-9,11-12H