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

Systemtic Name: N-(4-ethoxyphenyl)-1-[(E)-3-phenylprop-2-enoyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: N-(4-ethoxyphenyl)-1-[(E)-3-phenylprop-2-enoyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: N-(4-ethoxyphenyl)-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: N-(4-ethoxyphenyl)-1-[(E)-3-phenylprop-2-enoyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: 1-[(E)-3-phenylacryloyl]-N-p-phenetyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)N2CCC3(CC2)N(CCS3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)N2CCC3(CC2)N(CCS3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O3S/c1-2-31-22-11-9-21(10-12-22)26-24(30)27-16-14-25(15-17-27)28(18-19-32-25)23(29)13-8-20-6-4-3-5-7-20/h3-13H,2,14-19H2,1H3,(H,26,30)/b13-8+