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

Systemtic Name: 8-(4-bromophenyl)carbonyl-N-(2-methylbutyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: 8-(4-bromobenzoyl)-N-(2-methylbutyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: 8-[(4-bromophenyl)-oxomethyl]-N-(2-methylbutyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: 8-(4-bromobenzoyl)-N-(2-methylbutyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: 8-(4-bromobenzoyl)-N-(2-methylbutyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C20H28BrN3O2S MolecularWeight: 454.42422

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC(=O)C1CSC2(N1)CCN(CC2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC(C)CNC(=O)C1CSC2(N1)CCN(CC2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H28BrN3O2S/c1-3-14(2)12-22-18(25)17-13-27-20(23-17)8-10-24(11-9-20)19(26)15-4-6-16(21)7-5-15/h4-7,14,17,23H,3,8-13H2,1-2H3,(H,22,25)