8-(4-ethylphenyl)carbonyl-N-phenethyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide

Systemtic Name: 8-(4-ethylphenyl)carbonyl-N-phenethyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: 8-(4-ethylbenzoyl)-N-phenethyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: 8-[(4-ethylphenyl)-oxomethyl]-N-phenethyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: 8-(4-ethylbenzoyl)-N-phenethyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: 8-(4-ethylbenzoyl)-N-phenethyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCC3(CC2)NC(CS3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCC3(CC2)NC(CS3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O2S/c1-2-19-8-10-21(11-9-19)24(30)28-16-13-25(14-17-28)27-22(18-31-25)23(29)26-15-12-20-6-4-3-5-7-20/h3-11,22,27H,2,12-18H2,1H3,(H,26,29)