butyl 4-(3-methylsulfanylpropylcarbamothioylamino)benzoate

Systemtic Name: butyl 4-(3-methylsulfanylpropylcarbamothioylamino)benzoate Openeye Name: butyl 4-(3-methylsulfanylpropylcarbamothioylamino)benzoate CAS Name: 4-[[[3-(methylthio)propylamino]-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-(3-methylsulfanylpropylcarbamothioylamino)benzoate Traditional Name: 4-[3-(methylthio)propylthiocarbamoylamino]benzoic acid butyl ester Formula: C16H24N2O2S2 MolecularWeight: 340.50396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NCCCSC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NCCCSC

InChI

InChI=1S/C16H24N2O2S2/c1-3-4-11-20-15(19)13-6-8-14(9-7-13)18-16(21)17-10-5-12-22-2/h6-9H,3-5,10-12H2,1-2H3,(H2,17,18,21)