2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decan-3-yl)ethanone

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decan-3-yl)ethanone Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-[8-(2-thienylsulfonyl)-3,8-diazaspiro[4.5]decan-3-yl]ethanone CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-(8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decan-3-yl)ethanone IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1-(8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decan-3-yl)ethanone Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-1-[8-(2-thienylsulfonyl)-3,8-diazaspiro[4.5]decan-3-yl]ethanone Formula: C20H26N4O3S3 MolecularWeight: 466.64044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2CCC3(C2)CCN(CC3)S(=O)(=O)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2CCC3(C2)CCN(CC3)S(=O)(=O)C4=CC=CS4)C

InChI

InChI=1S/C20H26N4O3S3/c1-15-12-16(2)22-19(21-15)29-13-17(25)23-8-5-20(14-23)6-9-24(10-7-20)30(26,27)18-4-3-11-28-18/h3-4,11-12H,5-10,13-14H2,1-2H3