N-(5-bicyclo[2.2.1]hept-2-enyl)-8-(4-ethoxyphenyl)carbonyl-3,8-diazaspiro[4.5]decane-3-carbothioamide

Systemtic Name: N-(5-bicyclo[2.2.1]hept-2-enyl)-8-(4-ethoxyphenyl)carbonyl-3,8-diazaspiro[4.5]decane-3-carbothioamide Openeye Name: N-(5-bicyclo[2.2.1]hept-2-enyl)-8-(4-ethoxybenzoyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide CAS Name: N-(5-bicyclo[2.2.1]hept-2-enyl)-8-[(4-ethoxyphenyl)-oxomethyl]-3,8-diazaspiro[4.5]decane-3-carbothioamide IUPAC Name: N-(5-bicyclo[2.2.1]hept-2-enyl)-8-(4-ethoxybenzoyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Traditional Name: N-(5-bicyclo[2.2.1]hept-2-enyl)-8-(4-ethoxybenzoyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Formula: C25H33N3O2S MolecularWeight: 439.61342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)N2CCC3(CC2)CCN(C3)C(=S)NC4CC5CC4C=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N2CCC3(CC2)CCN(C3)C(=S)NC4CC5CC4C=C5

InChI

InChI=1S/C25H33N3O2S/c1-2-30-21-7-5-19(6-8-21)23(29)27-12-9-25(10-13-27)11-14-28(17-25)24(31)26-22-16-18-3-4-20(22)15-18/h3-8,18,20,22H,2,9-17H2,1H3,(H,26,31)