ethyl 4-(dihexylcarbamothioylamino)benzoate

Systemtic Name: ethyl 4-(dihexylcarbamothioylamino)benzoate Openeye Name: ethyl 4-(dihexylcarbamothioylamino)benzoate CAS Name: 4-[[(dihexylamino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(dihexylcarbamothioylamino)benzoate Traditional Name: 4-(dihexylthiocarbamoylamino)benzoic acid ethyl ester Formula: C22H36N2O2S MolecularWeight: 392.59844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C(=S)NC1=CC=C(C=C1)C(=O)OCC

Isomeric SMILES

CCCCCCN(CCCCCC)C(=S)NC1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C22H36N2O2S/c1-4-7-9-11-17-24(18-12-10-8-5-2)22(27)23-20-15-13-19(14-16-20)21(25)26-6-3/h13-16H,4-12,17-18H2,1-3H3,(H,23,27)