8-(2,5-dimethylphenyl)sulfonyl-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide

Systemtic Name: 8-(2,5-dimethylphenyl)sulfonyl-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Openeye Name: 8-(2,5-dimethylphenyl)sulfonyl-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide CAS Name: 8-(2,5-dimethylphenyl)sulfonyl-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide IUPAC Name: 8-(2,5-dimethylphenyl)sulfonyl-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Traditional Name: 8-(2,5-dimethylphenyl)sulfonyl-N-(1-phenylethyl)-3,8-diazaspiro[4.5]decane-3-carbothioamide Formula: C25H33N3O2S2 MolecularWeight: 471.67842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCC3(CC2)CCN(C3)C(=S)NC(C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCC3(CC2)CCN(C3)C(=S)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C25H33N3O2S2/c1-19-9-10-20(2)23(17-19)32(29,30)28-15-12-25(13-16-28)11-14-27(18-25)24(31)26-21(3)22-7-5-4-6-8-22/h4-10,17,21H,11-16,18H2,1-3H3,(H,26,31)