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

Systemtic Name: 8-(4-ethylphenyl)carbonyl-N-(2-methylpropyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: 8-(4-ethylbenzoyl)-N-isobutyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: 8-[(4-ethylphenyl)-oxomethyl]-N-(2-methylpropyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: 8-(4-ethylbenzoyl)-N-(2-methylpropyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: 8-(4-ethylbenzoyl)-N-isobutyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C21H31N3O2S MolecularWeight: 389.55474

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C21H31N3O2S/c1-4-16-5-7-17(8-6-16)20(26)24-11-9-21(10-12-24)23-18(14-27-21)19(25)22-13-15(2)3/h5-8,15,18,23H,4,9-14H2,1-3H3,(H,22,25)