ethyl (E)-3-[(3,4-dichlorophenyl)methylsulfanylcarbonylamino]but-2-enoate

Systemtic Name: ethyl (E)-3-[(3,4-dichlorophenyl)methylsulfanylcarbonylamino]but-2-enoate Openeye Name: ethyl (E)-3-[(3,4-dichlorophenyl)methylsulfanylcarbonylamino]but-2-enoate CAS Name: (E)-3-[[[(3,4-dichlorophenyl)methylthio]-oxomethyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(3,4-dichlorophenyl)methylsulfanylcarbonylamino]but-2-enoate Traditional Name: (E)-3-[[(3,4-dichlorobenzyl)thio]carbonylamino]but-2-enoic acid ethyl ester Formula: C14H15Cl2NO3S MolecularWeight: 348.2448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC(=O)SCC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC(=O)SCC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C14H15Cl2NO3S/c1-3-20-13(18)6-9(2)17-14(19)21-8-10-4-5-11(15)12(16)7-10/h4-7H,3,8H2,1-2H3,(H,17,19)/b9-6+