N-cyclohexyl-2-(3-phenylprop-2-ynoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide

Systemtic Name: N-cyclohexyl-2-(3-phenylprop-2-ynoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Openeye Name: N-cyclohexyl-2-(3-phenylprop-2-ynoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide CAS Name: N-cyclohexyl-2-[(1-oxo-3-phenylprop-2-ynyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide IUPAC Name: N-cyclohexyl-2-(3-phenylprop-2-ynoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Traditional Name: N-cyclohexyl-2-[(3-phenylpropioloyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide Formula: C25H28N2O2S MolecularWeight: 420.56702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=C(SC3=C2CCCCC3)NC(=O)C#CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=C(SC3=C2CCCCC3)NC(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C25H28N2O2S/c28-22(17-16-18-10-4-1-5-11-18)27-25-23(20-14-8-3-9-15-21(20)30-25)24(29)26-19-12-6-2-7-13-19/h1,4-5,10-11,19H,2-3,6-9,12-15H2,(H,26,29)(H,27,28)