4-chloranyl-N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-1-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-1-methyl-pyrazole-3-carboxamide Openeye Name: 4-chloro-N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-1-methyl-pyrazole-3-carboxamide CAS Name: 4-chloro-N-[[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-sulfanylidenemethyl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: 4-chloro-N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-1-methylpyrazole-3-carboxamide Traditional Name: 4-chloro-N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)thiocarbamoyl]-1-methyl-pyrazole-3-carboxamide Formula: C16H16ClN5OS2 MolecularWeight: 393.91414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC(=S)NC2=C(C3=C(S2)CCCCC3)C#N)Cl

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC(=S)NC2=C(C3=C(S2)CCCCC3)C#N)Cl

InChI

InChI=1S/C16H16ClN5OS2/c1-22-8-11(17)13(21-22)14(23)19-16(24)20-15-10(7-18)9-5-3-2-4-6-12(9)25-15/h8H,2-6H2,1H3,(H2,19,20,23,24)