methyl 4-[1-(4-bromophenyl)ethylcarbamothioylamino]benzoate

Systemtic Name: methyl 4-[1-(4-bromophenyl)ethylcarbamothioylamino]benzoate Openeye Name: methyl 4-[1-(4-bromophenyl)ethylcarbamothioylamino]benzoate CAS Name: 4-[[[1-(4-bromophenyl)ethylamino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[1-(4-bromophenyl)ethylcarbamothioylamino]benzoate Traditional Name: 4-[1-(4-bromophenyl)ethylthiocarbamoylamino]benzoic acid methyl ester Formula: C17H17BrN2O2S MolecularWeight: 393.29808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=S)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C1=CC=C(C=C1)Br)NC(=S)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H17BrN2O2S/c1-11(12-3-7-14(18)8-4-12)19-17(23)20-15-9-5-13(6-10-15)16(21)22-2/h3-11H,1-2H3,(H2,19,20,23)