8-[4-(5-iodanylthiophen-2-yl)-4-oxidanylidene-butyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one

Systemtic Name: 8-[4-(5-iodanylthiophen-2-yl)-4-oxidanylidene-butyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one Openeye Name: 8-[4-(5-iodanyl-2-thienyl)-4-oxo-butyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one CAS Name: 8-[4-(5-iodanyl-2-thiophenyl)-4-oxobutyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one IUPAC Name: 8-[4-(5-iodanylthiophen-2-yl)-4-oxobutyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one Traditional Name: 8-[4-(5-iodanyl-2-thienyl)-4-keto-butyl]-2-methyl-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one Formula: C22H26IN3O2S MolecularWeight: 519.431338

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Descriptors Computed from Structure

Canonical SMILES:

CN1CN(C2(C1=O)CCN(CC2)CCCC(=O)C3=CC=C(S3)I)C4=CC=CC=C4

Isomeric SMILES

CN1CN(C2(C1=O)CCN(CC2)CCCC(=O)C3=CC=C(S3)[123I])C4=CC=CC=C4

InChI

InChI=1S/C22H26IN3O2S/c1-24-16-26(17-6-3-2-4-7-17)22(21(24)28)11-14-25(15-12-22)13-5-8-18(27)19-9-10-20(23)29-19/h2-4,6-7,9-10H,5,8,11-16H2,1H3/i23-4