N-(1-propan-2-ylsulfanyloctyl)benzenecarbothioamide

Systemtic Name: N-(1-propan-2-ylsulfanyloctyl)benzenecarbothioamide Openeye Name: N-(1-isopropylsulfanyloctyl)benzenecarbothioamide CAS Name: N-[1-(propan-2-ylthio)octyl]benzenecarbothioamide IUPAC Name: N-(1-propan-2-ylsulfanyloctyl)benzenecarbothioamide Traditional Name: N-[1-(isopropylthio)octyl]thiobenzamide Formula: C18H29NS2 MolecularWeight: 323.55956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(NC(=S)C1=CC=CC=C1)SC(C)C

Isomeric SMILES

CCCCCCCC(NC(=S)C1=CC=CC=C1)SC(C)C

InChI

InChI=1S/C18H29NS2/c1-4-5-6-7-11-14-17(21-15(2)3)19-18(20)16-12-9-8-10-13-16/h8-10,12-13,15,17H,4-7,11,14H2,1-3H3,(H,19,20)