(4E)-4-[3-(4-methylphenyl)sulfonyl-2-oxidanylidene-1-(phenylmethyl)imidazolidin-4-ylidene]butanal

Systemtic Name: (4E)-4-[3-(4-methylphenyl)sulfonyl-2-oxidanylidene-1-(phenylmethyl)imidazolidin-4-ylidene]butanal Openeye Name: (4E)-4-[1-benzyl-2-oxo-3-(p-tolylsulfonyl)imidazolidin-4-ylidene]butanal CAS Name: (4E)-4-[3-(4-methylphenyl)sulfonyl-2-oxo-1-(phenylmethyl)-4-imidazolidinylidene]butanal IUPAC Name: (4E)-4-[1-benzyl-3-(4-methylphenyl)sulfonyl-2-oxoimidazolidin-4-ylidene]butanal Traditional Name: (4E)-4-(1-benzyl-2-keto-3-tosyl-imidazolidin-4-ylidene)butyraldehyde Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=CCCC=O)CN(C2=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2/C(=C/CCC=O)/CN(C2=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4S/c1-17-10-12-20(13-11-17)28(26,27)23-19(9-5-6-14-24)16-22(21(23)25)15-18-7-3-2-4-8-18/h2-4,7-14H,5-6,15-16H2,1H3/b19-9+