S-(3-methylidenepent-4-en-2-yl) benzenecarbothioate

Systemtic Name: S-(3-methylidenepent-4-en-2-yl) benzenecarbothioate Openeye Name: S-(1-methyl-2-methylene-but-3-enyl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-(3-methylenepent-4-en-2-yl) ester IUPAC Name: S-(3-methylidenepent-4-en-2-yl) benzenecarbothioate Traditional Name: thiobenzoic acid S-(1-methyl-2-methylene-but-3-enyl) ester Formula: C13H14OS MolecularWeight: 218.31466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=C)C=C)SC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C(=C)C=C)SC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H14OS/c1-4-10(2)11(3)15-13(14)12-8-6-5-7-9-12/h4-9,11H,1-2H2,3H3