N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(1-pyrazolylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxamide Formula: C17H16N6OS MolecularWeight: 352.41354

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=NN(C=C3)CN4C=CC=N4)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=NN(C=C3)CN4C=CC=N4)C#N

InChI

InChI=1S/C17H16N6OS/c18-10-13-12-4-1-2-5-15(12)25-17(13)20-16(24)14-6-9-23(21-14)11-22-8-3-7-19-22/h3,6-9H,1-2,4-5,11H2,(H,20,24)