ethyl 4-(dipentylcarbamothioylamino)benzoate

Systemtic Name: ethyl 4-(dipentylcarbamothioylamino)benzoate Openeye Name: ethyl 4-(dipentylcarbamothioylamino)benzoate CAS Name: 4-[[(dipentylamino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(dipentylcarbamothioylamino)benzoate Traditional Name: 4-(diamylthiocarbamoylamino)benzoic acid ethyl ester Formula: C20H32N2O2S MolecularWeight: 364.54528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=S)NC1=CC=C(C=C1)C(=O)OCC

Isomeric SMILES

CCCCCN(CCCCC)C(=S)NC1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C20H32N2O2S/c1-4-7-9-15-22(16-10-8-5-2)20(25)21-18-13-11-17(12-14-18)19(23)24-6-3/h11-14H,4-10,15-16H2,1-3H3,(H,21,25)