(4-tert-butylphenyl) N-[3-(diethylcarbamothioylsulfanyl)propanoyl]carbamate

Systemtic Name: (4-tert-butylphenyl) N-[3-(diethylcarbamothioylsulfanyl)propanoyl]carbamate Openeye Name: (4-tert-butylphenyl) N-[3-(diethylcarbamothioylsulfanyl)propanoyl]carbamate CAS Name: N-[3-[[diethylamino(sulfanylidene)methyl]thio]-1-oxopropyl]carbamic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) N-[3-(diethylcarbamothioylsulfanyl)propanoyl]carbamate Traditional Name: N-[3-(diethylthiocarbamoylthio)propanoyl]carbamic acid (4-tert-butylphenyl) ester Formula: C19H28N2O3S2 MolecularWeight: 396.56722

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCCC(=O)NC(=O)OC1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

CCN(CC)C(=S)SCCC(=O)NC(=O)OC1=CC=C(C=C1)C(C)(C)C

InChI

InChI=1S/C19H28N2O3S2/c1-6-21(7-2)18(25)26-13-12-16(22)20-17(23)24-15-10-8-14(9-11-15)19(3,4)5/h8-11H,6-7,12-13H2,1-5H3,(H,20,22,23)