3-methoxy-4-(3-methylbutoxy)benzenecarbothioamide

Systemtic Name: 3-methoxy-4-(3-methylbutoxy)benzenecarbothioamide Openeye Name: 4-isopentyloxy-3-methoxy-benzenecarbothioamide CAS Name: 3-methoxy-4-(3-methylbutoxy)benzenecarbothioamide IUPAC Name: 3-methoxy-4-(3-methylbutoxy)benzenecarbothioamide Traditional Name: 4-isoamoxy-3-methoxy-thiobenzamide Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=S)N)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=S)N)OC

InChI

InChI=1S/C13H19NO2S/c1-9(2)6-7-16-11-5-4-10(13(14)17)8-12(11)15-3/h4-5,8-9H,6-7H2,1-3H3,(H2,14,17)