8-(3-bromophenyl)carbonyl-N-(2-methylpropyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide

Systemtic Name: 8-(3-bromophenyl)carbonyl-N-(2-methylpropyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: 8-(3-bromobenzoyl)-N-isobutyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: 8-[(3-bromophenyl)-oxomethyl]-N-(2-methylpropyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: 8-(3-bromobenzoyl)-N-(2-methylpropyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: 8-(3-bromobenzoyl)-N-isobutyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C19H26BrN3O2S MolecularWeight: 440.39764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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