3-(5-bromanylfuran-2-yl)carbonyl-N-(3-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: 3-(5-bromanylfuran-2-yl)carbonyl-N-(3-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Openeye Name: 3-(5-bromofuran-2-carbonyl)-N-(3-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide CAS Name: 3-[(5-bromo-2-furanyl)-oxomethyl]-N-(3-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide IUPAC Name: 3-(5-bromofuran-2-carbonyl)-N-(3-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Traditional Name: 3-(5-bromo-2-furoyl)-N-(3-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Formula: C21H24BrN3O3S MolecularWeight: 478.40256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)C4=CC=C(O4)Br

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)C4=CC=C(O4)Br

InChI

InChI=1S/C21H24BrN3O3S/c1-27-16-4-2-3-15(13-16)23-20(29)24-10-7-21(8-11-24)9-12-25(14-21)19(26)17-5-6-18(22)28-17/h2-6,13H,7-12,14H2,1H3,(H,23,29)