butyl 4-(hexanoylcarbamothioylamino)benzoate

Systemtic Name: butyl 4-(hexanoylcarbamothioylamino)benzoate Openeye Name: butyl 4-(hexanoylcarbamothioylamino)benzoate CAS Name: 4-[[(1-oxohexylamino)-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-(hexanoylcarbamothioylamino)benzoate Traditional Name: 4-(caproylthiocarbamoylamino)benzoic acid butyl ester Formula: C18H26N2O3S MolecularWeight: 350.47564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)OCCCC

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)OCCCC

InChI

InChI=1S/C18H26N2O3S/c1-3-5-7-8-16(21)20-18(24)19-15-11-9-14(10-12-15)17(22)23-13-6-4-2/h9-12H,3-8,13H2,1-2H3,(H2,19,20,21,24)