3-chloranyl-4-hexoxy-5-methoxy-benzenecarbothioamide

Systemtic Name: 3-chloranyl-4-hexoxy-5-methoxy-benzenecarbothioamide Openeye Name: 3-chloro-4-hexoxy-5-methoxy-benzenecarbothioamide CAS Name: 3-chloro-4-hexoxy-5-methoxybenzenecarbothioamide IUPAC Name: 3-chloro-4-hexoxy-5-methoxybenzenecarbothioamide Traditional Name: 3-chloro-4-hexoxy-5-methoxy-thiobenzamide Formula: C14H20ClNO2S MolecularWeight: 301.8321

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Cl)C(=S)N)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Cl)C(=S)N)OC

InChI

InChI=1S/C14H20ClNO2S/c1-3-4-5-6-7-18-13-11(15)8-10(14(16)19)9-12(13)17-2/h8-9H,3-7H2,1-2H3,(H2,16,19)