3-(2-methylpropyl)-5-(phenylmethyl)-1,2,4-trithiolane

Systemtic Name: 3-(2-methylpropyl)-5-(phenylmethyl)-1,2,4-trithiolane Openeye Name: 3-benzyl-5-isobutyl-1,2,4-trithiolane CAS Name: 3-(2-methylpropyl)-5-(phenylmethyl)-1,2,4-trithiolane IUPAC Name: 3-benzyl-5-(2-methylpropyl)-1,2,4-trithiolane Traditional Name: 3-benzyl-5-isobutyl-1,2,4-trithiolane Formula: C13H18S3 MolecularWeight: 270.47702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1SC(SS1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)CC1SC(SS1)CC2=CC=CC=C2

InChI

InChI=1S/C13H18S3/c1-10(2)8-12-14-13(16-15-12)9-11-6-4-3-5-7-11/h3-7,10,12-13H,8-9H2,1-2H3