S-(quinolin-6-ylmethyl) ethanethioate

Systemtic Name: S-(quinolin-6-ylmethyl) ethanethioate Openeye Name: S-(6-quinolylmethyl) ethanethioate CAS Name: ethanethioic acid S-(6-quinolinylmethyl) ester IUPAC Name: S-(quinolin-6-ylmethyl) ethanethioate Traditional Name: ethanethioic acid S-(6-quinolylmethyl) ester Formula: C12H11NOS MolecularWeight: 217.28684

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=CC2=C(C=C1)N=CC=C2

Isomeric SMILES

CC(=O)SCC1=CC2=C(C=C1)N=CC=C2

InChI

InChI=1S/C12H11NOS/c1-9(14)15-8-10-4-5-12-11(7-10)3-2-6-13-12/h2-7H,8H2,1H3