N-(2,4-dimethylphenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide

Systemtic Name: N-(2,4-dimethylphenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: N-(2,4-dimethylphenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: N-(2,4-dimethylphenyl)-1-(3-methyl-1-oxobutyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: N-(2,4-dimethylphenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: N-(2,4-dimethylphenyl)-1-isovaleryl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C21H31N3O2S MolecularWeight: 389.55474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)N2CCC3(CC2)N(CCS3)C(=O)CC(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)N2CCC3(CC2)N(CCS3)C(=O)CC(C)C)C

InChI

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