butyl 4-[2-(diethylcarbamothioylsulfanyl)ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-(diethylcarbamothioylsulfanyl)ethanoylamino]benzoate Openeye Name: butyl 4-[[2-(diethylcarbamothioylsulfanyl)acetyl]amino]benzoate CAS Name: 4-[[2-[[diethylamino(sulfanylidene)methyl]thio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(diethylcarbamothioylsulfanyl)acetyl]amino]benzoate Traditional Name: 4-[[2-(diethylthiocarbamoylthio)acetyl]amino]benzoic acid butyl ester Formula: C18H26N2O3S2 MolecularWeight: 382.54064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC(=S)N(CC)CC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC(=S)N(CC)CC

InChI

InChI=1S/C18H26N2O3S2/c1-4-7-12-23-17(22)14-8-10-15(11-9-14)19-16(21)13-25-18(24)20(5-2)6-3/h8-11H,4-7,12-13H2,1-3H3,(H,19,21)