5-butan-2-yl-3-(phenylmethyl)thiolan-2-one

Systemtic Name: 5-butan-2-yl-3-(phenylmethyl)thiolan-2-one Openeye Name: 3-benzyl-5-sec-butyl-tetrahydrothiophen-2-one CAS Name: 5-butan-2-yl-3-(phenylmethyl)-2-thiolanone IUPAC Name: 3-benzyl-5-butan-2-ylthiolan-2-one Traditional Name: 3-benzyl-5-sec-butyl-tetrahydrothiophen-2-one Formula: C15H20OS MolecularWeight: 248.3837

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1CC(C(=O)S1)CC2=CC=CC=C2

Isomeric SMILES

CCC(C)C1CC(C(=O)S1)CC2=CC=CC=C2

InChI

InChI=1S/C15H20OS/c1-3-11(2)14-10-13(15(16)17-14)9-12-7-5-4-6-8-12/h4-8,11,13-14H,3,9-10H2,1-2H3