ethyl 4-(dodecylsulfanylcarbonylamino)benzoate

Systemtic Name: ethyl 4-(dodecylsulfanylcarbonylamino)benzoate Openeye Name: ethyl 4-(dodecylsulfanylcarbonylamino)benzoate CAS Name: 4-[[(dodecylthio)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(dodecylsulfanylcarbonylamino)benzoate Traditional Name: 4-[(laurylthio)carbonylamino]benzoic acid ethyl ester Formula: C22H35NO3S MolecularWeight: 393.5832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(=O)NC1=CC=C(C=C1)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCSC(=O)NC1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C22H35NO3S/c1-3-5-6-7-8-9-10-11-12-13-18-27-22(25)23-20-16-14-19(15-17-20)21(24)26-4-2/h14-17H,3-13,18H2,1-2H3,(H,23,25)