N-(3-methoxyphenyl)-3-(5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl)carbonyl-3,8-diazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: N-(3-methoxyphenyl)-3-(5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl)carbonyl-3,8-diazaspiro[4.5]decane-8-carbothioamide Openeye Name: N-(3-methoxyphenyl)-3-(5-oxo-1-phenethyl-pyrrolidine-3-carbonyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide CAS Name: N-(3-methoxyphenyl)-3-[oxo-(5-oxo-1-phenethyl-3-pyrrolidinyl)methyl]-3,8-diazaspiro[4.5]decane-8-carbothioamide IUPAC Name: N-(3-methoxyphenyl)-3-(5-oxo-1-phenethylpyrrolidine-3-carbonyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Traditional Name: 3-(5-keto-1-phenethyl-pyrrolidine-3-carbonyl)-N-(3-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Formula: C29H36N4O3S MolecularWeight: 520.68614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)C4CC(=O)N(C4)CCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)C4CC(=O)N(C4)CCC5=CC=CC=C5

InChI

InChI=1S/C29H36N4O3S/c1-36-25-9-5-8-24(19-25)30-28(37)31-15-11-29(12-16-31)13-17-33(21-29)27(35)23-18-26(34)32(20-23)14-10-22-6-3-2-4-7-22/h2-9,19,23H,10-18,20-21H2,1H3,(H,30,37)