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

Systemtic Name: N-(3,5-dimethylphenyl)-3-(5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl)carbonyl-3,8-diazaspiro[4.5]decane-8-carbothioamide Openeye Name: N-(3,5-dimethylphenyl)-3-(5-oxo-1-phenethyl-pyrrolidine-3-carbonyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide CAS Name: N-(3,5-dimethylphenyl)-3-[oxo-(5-oxo-1-phenethyl-3-pyrrolidinyl)methyl]-3,8-diazaspiro[4.5]decane-8-carbothioamide IUPAC Name: N-(3,5-dimethylphenyl)-3-(5-oxo-1-phenethylpyrrolidine-3-carbonyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Traditional Name: N-(3,5-dimethylphenyl)-3-(5-keto-1-phenethyl-pyrrolidine-3-carbonyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Formula: C30H38N4O2S MolecularWeight: 518.71332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)C4CC(=O)N(C4)CCC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)C4CC(=O)N(C4)CCC5=CC=CC=C5)C

InChI

InChI=1S/C30H38N4O2S/c1-22-16-23(2)18-26(17-22)31-29(37)32-13-9-30(10-14-32)11-15-34(21-30)28(36)25-19-27(35)33(20-25)12-8-24-6-4-3-5-7-24/h3-7,16-18,25H,8-15,19-21H2,1-2H3,(H,31,37)