3-(6-bromanylhexylsulfanyl)-2-butyl-N,N-diethyl-benzamide

Systemtic Name: 3-(6-bromanylhexylsulfanyl)-2-butyl-N,N-diethyl-benzamide Openeye Name: 3-(6-bromohexylsulfanyl)-2-butyl-N,N-diethyl-benzamide CAS Name: 3-(6-bromohexylthio)-2-butyl-N,N-diethylbenzamide IUPAC Name: 3-(6-bromohexylsulfanyl)-2-butyl-N,N-diethylbenzamide Traditional Name: 3-(6-bromohexylthio)-2-butyl-N,N-diethyl-benzamide Formula: C21H34BrNOS MolecularWeight: 428.46976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC=C1SCCCCCCBr)C(=O)N(CC)CC

Isomeric SMILES

CCCCC1=C(C=CC=C1SCCCCCCBr)C(=O)N(CC)CC

InChI

InChI=1S/C21H34BrNOS/c1-4-7-13-18-19(21(24)23(5-2)6-3)14-12-15-20(18)25-17-11-9-8-10-16-22/h12,14-15H,4-11,13,16-17H2,1-3H3