N-(3-chloranyl-4-methyl-phenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-1-(3-methyl-1-oxobutyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-1-isovaleryl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C20H28ClN3O2S MolecularWeight: 409.97322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28ClN3O2S/c1-14(2)12-18(25)24-10-11-27-20(24)6-8-23(9-7-20)19(26)22-16-5-4-15(3)17(21)13-16/h4-5,13-14H,6-12H2,1-3H3,(H,22,26)