8-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-N-(4-methylsulfanylphenyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide

Systemtic Name: 8-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-N-(4-methylsulfanylphenyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Openeye Name: 8-(7-methoxybenzofuran-2-carbonyl)-N-(4-methylsulfanylphenyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide CAS Name: 8-[(7-methoxy-2-benzofuranyl)-oxomethyl]-N-[4-(methylthio)phenyl]-3,8-diazaspiro[4.5]decane-3-carbothioamide IUPAC Name: 8-(7-methoxy-1-benzofuran-2-carbonyl)-N-(4-methylsulfanylphenyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Traditional Name: 8-(7-methoxybenzofuran-2-carbonyl)-N-[4-(methylthio)phenyl]-3,8-diazaspiro[4.5]decane-3-carbothioamide Formula: C26H29N3O3S2 MolecularWeight: 495.65676

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=C2)C(=O)N3CCC4(CC3)CCN(C4)C(=S)NC5=CC=C(C=C5)SC

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2)C(=O)N3CCC4(CC3)CCN(C4)C(=S)NC5=CC=C(C=C5)SC

InChI

InChI=1S/C26H29N3O3S2/c1-31-21-5-3-4-18-16-22(32-23(18)21)24(30)28-13-10-26(11-14-28)12-15-29(17-26)25(33)27-19-6-8-20(34-2)9-7-19/h3-9,16H,10-15,17H2,1-2H3,(H,27,33)