S-pent-4-ynyl 4-chloranylbenzenecarbothioate

Systemtic Name: S-pent-4-ynyl 4-chloranylbenzenecarbothioate Openeye Name: S-pent-4-ynyl 4-chlorobenzenecarbothioate CAS Name: 4-chlorobenzenecarbothioic acid S-pent-4-ynyl ester IUPAC Name: S-pent-4-ynyl 4-chlorobenzenecarbothioate Traditional Name: 4-chlorothiobenzoic acid S-pent-4-ynyl ester Formula: C12H11ClOS MolecularWeight: 238.73314

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCSC(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

C#CCCCSC(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C12H11ClOS/c1-2-3-4-9-15-12(14)10-5-7-11(13)8-6-10/h1,5-8H,3-4,9H2