8-(4-ethoxy-3,5-dimethyl-phenyl)sulfonyl-1-thiophen-2-ylsulfonyl-4-oxa-1,8-diazaspiro[4.5]decane

Systemtic Name: 8-(4-ethoxy-3,5-dimethyl-phenyl)sulfonyl-1-thiophen-2-ylsulfonyl-4-oxa-1,8-diazaspiro[4.5]decane Openeye Name: 8-(4-ethoxy-3,5-dimethyl-phenyl)sulfonyl-1-(2-thienylsulfonyl)-4-oxa-1,8-diazaspiro[4.5]decane CAS Name: 8-(4-ethoxy-3,5-dimethylphenyl)sulfonyl-1-thiophen-2-ylsulfonyl-4-oxa-1,8-diazaspiro[4.5]decane IUPAC Name: 8-(4-ethoxy-3,5-dimethylphenyl)sulfonyl-1-thiophen-2-ylsulfonyl-4-oxa-1,8-diazaspiro[4.5]decane Traditional Name: 8-(4-ethoxy-3,5-dimethyl-phenyl)sulfonyl-1-(2-thienylsulfonyl)-4-oxa-1,8-diazaspiro[4.5]decane Formula: C21H28N2O6S3 MolecularWeight: 500.65182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1C)S(=O)(=O)N2CCC3(CC2)N(CCO3)S(=O)(=O)C4=CC=CS4)C

Isomeric SMILES

CCOC1=C(C=C(C=C1C)S(=O)(=O)N2CCC3(CC2)N(CCO3)S(=O)(=O)C4=CC=CS4)C

InChI

InChI=1S/C21H28N2O6S3/c1-4-28-20-16(2)14-18(15-17(20)3)31(24,25)22-9-7-21(8-10-22)23(11-12-29-21)32(26,27)19-6-5-13-30-19/h5-6,13-15H,4,7-12H2,1-3H3