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

Systemtic Name: 8-(4-ethylphenyl)carbonyl-N-(2-methylbutyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: 8-(4-ethylbenzoyl)-N-(2-methylbutyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: 8-[(4-ethylphenyl)-oxomethyl]-N-(2-methylbutyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: 8-(4-ethylbenzoyl)-N-(2-methylbutyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: 8-(4-ethylbenzoyl)-N-(2-methylbutyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C22H33N3O2S MolecularWeight: 403.58132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33N3O2S/c1-4-16(3)14-23-20(26)19-15-28-22(24-19)10-12-25(13-11-22)21(27)18-8-6-17(5-2)7-9-18/h6-9,16,19,24H,4-5,10-15H2,1-3H3,(H,23,26)