3-(2,4-dimethoxypyrimidin-5-yl)-1-(8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decan-3-yl)prop-2-en-1-one

Systemtic Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-(8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decan-3-yl)prop-2-en-1-one Openeye Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-[8-(2-thienylsulfonyl)-3,8-diazaspiro[4.5]decan-3-yl]prop-2-en-1-one CAS Name: 3-(2,4-dimethoxy-5-pyrimidinyl)-1-(8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decan-3-yl)-2-propen-1-one IUPAC Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-(8-thiophen-2-ylsulfonyl-3,8-diazaspiro[4.5]decan-3-yl)prop-2-en-1-one Traditional Name: 3-(2,4-dimethoxypyrimidin-5-yl)-1-[8-(2-thienylsulfonyl)-3,8-diazaspiro[4.5]decan-3-yl]prop-2-en-1-one Formula: C21H26N4O5S2 MolecularWeight: 478.58494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1C=CC(=O)N2CCC3(C2)CCN(CC3)S(=O)(=O)C4=CC=CS4)OC

Isomeric SMILES

COC1=NC(=NC=C1C=CC(=O)N2CCC3(C2)CCN(CC3)S(=O)(=O)C4=CC=CS4)OC

InChI

InChI=1S/C21H26N4O5S2/c1-29-19-16(14-22-20(23-19)30-2)5-6-17(26)24-10-7-21(15-24)8-11-25(12-9-21)32(27,28)18-4-3-13-31-18/h3-6,13-14H,7-12,15H2,1-2H3