N-(2-methylphenyl)-1-[(E)-3-phenylprop-2-enoyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide

Systemtic Name: N-(2-methylphenyl)-1-[(E)-3-phenylprop-2-enoyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: N-(o-tolyl)-1-[(E)-3-phenylprop-2-enoyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: N-(2-methylphenyl)-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: N-(2-methylphenyl)-1-[(E)-3-phenylprop-2-enoyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: N-(o-tolyl)-1-[(E)-3-phenylacryloyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C24H27N3O2S MolecularWeight: 421.55508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)N2CCC3(CC2)N(CCS3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1NC(=O)N2CCC3(CC2)N(CCS3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O2S/c1-19-7-5-6-10-21(19)25-23(29)26-15-13-24(14-16-26)27(17-18-30-24)22(28)12-11-20-8-3-2-4-9-20/h2-12H,13-18H2,1H3,(H,25,29)/b12-11+