5-[5-methyl-1-(phenylmethyl)imidazol-4-yl]thiolan-3-one

Systemtic Name: 5-[5-methyl-1-(phenylmethyl)imidazol-4-yl]thiolan-3-one Openeye Name: 5-(1-benzyl-5-methyl-imidazol-4-yl)tetrahydrothiophen-3-one CAS Name: 5-[5-methyl-1-(phenylmethyl)-4-imidazolyl]-3-thiolanone IUPAC Name: 5-(1-benzyl-5-methylimidazol-4-yl)thiolan-3-one Traditional Name: 5-(1-benzyl-5-methyl-imidazol-4-yl)tetrahydrothiophen-3-one Formula: C15H16N2OS MolecularWeight: 272.36534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1CC2=CC=CC=C2)C3CC(=O)CS3

Isomeric SMILES

CC1=C(N=CN1CC2=CC=CC=C2)C3CC(=O)CS3

InChI

InChI=1S/C15H16N2OS/c1-11-15(14-7-13(18)9-19-14)16-10-17(11)8-12-5-3-2-4-6-12/h2-6,10,14H,7-9H2,1H3