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

Systemtic Name: N-(3-bromophenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: N-(3-bromophenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: N-(3-bromophenyl)-1-(3-methyl-1-oxobutyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: N-(3-bromophenyl)-1-(3-methylbutanoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: N-(3-bromophenyl)-1-isovaleryl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C19H26BrN3O2S MolecularWeight: 440.39764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCSC12CCN(CC2)C(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)CC(=O)N1CCSC12CCN(CC2)C(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H26BrN3O2S/c1-14(2)12-17(24)23-10-11-26-19(23)6-8-22(9-7-19)18(25)21-16-5-3-4-15(20)13-16/h3-5,13-14H,6-12H2,1-2H3,(H,21,25)