4-butan-2-ylsulfanyl-N-methyl-benzenecarbothioamide

Systemtic Name: 4-butan-2-ylsulfanyl-N-methyl-benzenecarbothioamide Openeye Name: N-methyl-4-sec-butylsulfanyl-benzenecarbothioamide CAS Name: 4-(butan-2-ylthio)-N-methylbenzenecarbothioamide IUPAC Name: 4-butan-2-ylsulfanyl-N-methylbenzenecarbothioamide Traditional Name: N-methyl-4-(sec-butylthio)thiobenzamide Formula: C12H17NS2 MolecularWeight: 239.40008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=CC=C(C=C1)C(=S)NC

Isomeric SMILES

CCC(C)SC1=CC=C(C=C1)C(=S)NC

InChI

InChI=1S/C12H17NS2/c1-4-9(2)15-11-7-5-10(6-8-11)12(14)13-3/h5-9H,4H2,1-3H3,(H,13,14)