1-tert-butyl-3-thiophen-2-yl-pyrazole-4-carbonitrile

Systemtic Name: 1-tert-butyl-3-thiophen-2-yl-pyrazole-4-carbonitrile Openeye Name: 1-tert-butyl-3-(2-thienyl)pyrazole-4-carbonitrile CAS Name: 1-tert-butyl-3-thiophen-2-yl-4-pyrazolecarbonitrile IUPAC Name: 1-tert-butyl-3-thiophen-2-ylpyrazole-4-carbonitrile Traditional Name: 1-tert-butyl-3-(2-thienyl)pyrazole-4-carbonitrile Formula: C12H13N3S MolecularWeight: 231.31672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=N1)C2=CC=CS2)C#N

Isomeric SMILES

CC(C)(C)N1C=C(C(=N1)C2=CC=CS2)C#N

InChI

InChI=1S/C12H13N3S/c1-12(2,3)15-8-9(7-13)11(14-15)10-5-4-6-16-10/h4-6,8H,1-3H3