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

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,3,5-trimethyl-pyrazole-4-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1,3,5-trimethyl-pyrazole-4-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,3,5-trimethyl-4-pyrazolecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,3,5-trimethylpyrazole-4-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1,3,5-trimethyl-pyrazole-4-carboxamide Formula: C16H18N4OS MolecularWeight: 314.40532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)NC2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C16H18N4OS/c1-9-14(10(2)20(3)19-9)15(21)18-16-12(8-17)11-6-4-5-7-13(11)22-16/h4-7H2,1-3H3,(H,18,21)