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

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-methyl-pyrazole-4-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-methyl-pyrazole-4-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-methyl-4-pyrazolecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-methylpyrazole-4-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1-methyl-pyrazole-4-carboxamide Formula: C14H14N4OS MolecularWeight: 286.35216

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

CN1C=C(C=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C14H14N4OS/c1-18-8-9(7-16-18)13(19)17-14-11(6-15)10-4-2-3-5-12(10)20-14/h7-8H,2-5H2,1H3,(H,17,19)