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

Systemtic Name: N-(1-adamantyl)-1-(4-bromophenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: N-(1-adamantyl)-1-(4-bromobenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: N-(1-adamantyl)-1-[(4-bromophenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: N-(1-adamantyl)-1-(4-bromobenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: N-(1-adamantyl)-1-(4-bromobenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C25H32BrN3O2S MolecularWeight: 518.50948

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12N(CCS2)C(=O)C3=CC=C(C=C3)Br)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCC12N(CCS2)C(=O)C3=CC=C(C=C3)Br)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C25H32BrN3O2S/c26-21-3-1-20(2-4-21)22(30)29-9-10-32-25(29)5-7-28(8-6-25)23(31)27-24-14-17-11-18(15-24)13-19(12-17)16-24/h1-4,17-19H,5-16H2,(H,27,31)