N-(4-pyrazol-1-ylphenyl)-6-[(E)-3-thiophen-2-ylprop-2-enoyl]-6-azaspiro[2.5]octane-2-carboxamide

Systemtic Name: N-(4-pyrazol-1-ylphenyl)-6-[(E)-3-thiophen-2-ylprop-2-enoyl]-6-azaspiro[2.5]octane-2-carboxamide Openeye Name: N-(4-pyrazol-1-ylphenyl)-6-[(E)-3-(2-thienyl)prop-2-enoyl]-6-azaspiro[2.5]octane-2-carboxamide CAS Name: 6-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-N-[4-(1-pyrazolyl)phenyl]-6-azaspiro[2.5]octane-2-carboxamide IUPAC Name: N-(4-pyrazol-1-ylphenyl)-6-[(E)-3-thiophen-2-ylprop-2-enoyl]-6-azaspiro[2.5]octane-2-carboxamide Traditional Name: N-(4-pyrazol-1-ylphenyl)-6-[(E)-3-(2-thienyl)acryloyl]-6-azaspiro[2.5]octane-2-carboxamide Formula: C24H24N4O2S MolecularWeight: 432.53796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12CC2C(=O)NC3=CC=C(C=C3)N4C=CC=N4)C(=O)C=CC5=CC=CS5

Isomeric SMILES

C1CN(CCC12CC2C(=O)NC3=CC=C(C=C3)N4C=CC=N4)C(=O)/C=C/C5=CC=CS5

InChI

InChI=1S/C24H24N4O2S/c29-22(9-8-20-3-1-16-31-20)27-14-10-24(11-15-27)17-21(24)23(30)26-18-4-6-19(7-5-18)28-13-2-12-25-28/h1-9,12-13,16,21H,10-11,14-15,17H2,(H,26,30)/b9-8+