2-[(3-bromophenyl)methyl]-8-(2-ethylsulfanylpyridin-3-yl)carbonyl-4-oxa-2,8-diazaspiro[4.5]decan-3-one

Systemtic Name: 2-[(3-bromophenyl)methyl]-8-(2-ethylsulfanylpyridin-3-yl)carbonyl-4-oxa-2,8-diazaspiro[4.5]decan-3-one Openeye Name: 2-[(3-bromophenyl)methyl]-8-(2-ethylsulfanylpyridine-3-carbonyl)-4-oxa-2,8-diazaspiro[4.5]decan-3-one CAS Name: 2-[(3-bromophenyl)methyl]-8-[[2-(ethylthio)-3-pyridinyl]-oxomethyl]-4-oxa-2,8-diazaspiro[4.5]decan-3-one IUPAC Name: 2-[(3-bromophenyl)methyl]-8-(2-ethylsulfanylpyridine-3-carbonyl)-4-oxa-2,8-diazaspiro[4.5]decan-3-one Traditional Name: 2-(3-bromobenzyl)-8-[2-(ethylthio)nicotinoyl]-4-oxa-2,8-diazaspiro[4.5]decan-3-one Formula: C22H24BrN3O3S MolecularWeight: 490.41326

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=CC=N1)C(=O)N2CCC3(CC2)CN(C(=O)O3)CC4=CC(=CC=C4)Br

Isomeric SMILES

CCSC1=C(C=CC=N1)C(=O)N2CCC3(CC2)CN(C(=O)O3)CC4=CC(=CC=C4)Br

InChI

InChI=1S/C22H24BrN3O3S/c1-2-30-19-18(7-4-10-24-19)20(27)25-11-8-22(9-12-25)15-26(21(28)29-22)14-16-5-3-6-17(23)13-16/h3-7,10,13H,2,8-9,11-12,14-15H2,1H3