S-ethyl 1-bromanyl-4-ethyl-5-(2-methoxyethoxy)cyclohexa-2,4-diene-1-carbothioate

Systemtic Name: S-ethyl 1-bromanyl-4-ethyl-5-(2-methoxyethoxy)cyclohexa-2,4-diene-1-carbothioate Openeye Name: S-ethyl 1-bromo-4-ethyl-5-(2-methoxyethoxy)cyclohexa-2,4-diene-1-carbothioate CAS Name: 1-bromo-4-ethyl-5-(2-methoxyethoxy)-1-cyclohexa-2,4-dienecarbothioic acid S-ethyl ester IUPAC Name: S-ethyl 1-bromo-4-ethyl-5-(2-methoxyethoxy)cyclohexa-2,4-diene-1-carbothioate Traditional Name: 1-bromo-4-ethyl-5-(2-methoxyethoxy)cyclohexa-2,4-diene-1-carbothioic acid S-ethyl ester Formula: C14H21BrO3S MolecularWeight: 349.28374

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(CC(C=C1)(C(=O)SCC)Br)OCCOC

Isomeric SMILES

CCC1=C(CC(C=C1)(C(=O)SCC)Br)OCCOC

InChI

InChI=1S/C14H21BrO3S/c1-4-11-6-7-14(15,13(16)19-5-2)10-12(11)18-9-8-17-3/h6-7H,4-5,8-10H2,1-3H3