N-methyl-4-pentan-2-ylsulfanyl-benzenecarbothioamide

Systemtic Name: N-methyl-4-pentan-2-ylsulfanyl-benzenecarbothioamide Openeye Name: N-methyl-4-(1-methylbutylsulfanyl)benzenecarbothioamide CAS Name: N-methyl-4-(pentan-2-ylthio)benzenecarbothioamide IUPAC Name: N-methyl-4-pentan-2-ylsulfanylbenzenecarbothioamide Traditional Name: N-methyl-4-(1-methylbutylthio)thiobenzamide Formula: C13H19NS2 MolecularWeight: 253.42666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NS2/c1-4-5-10(2)16-12-8-6-11(7-9-12)13(15)14-3/h6-10H,4-5H2,1-3H3,(H,14,15)