methyl 4-[[(4-methoxyphenyl)methylcarbamothioylamino]carbamoyl]benzoate

Systemtic Name: methyl 4-[[(4-methoxyphenyl)methylcarbamothioylamino]carbamoyl]benzoate Openeye Name: methyl 4-[[(4-methoxyphenyl)methylcarbamothioylamino]carbamoyl]benzoate CAS Name: 4-[[[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]hydrazo]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(4-methoxyphenyl)methylcarbamothioylamino]carbamoyl]benzoate Traditional Name: 4-[(p-anisylthiocarbamoylamino)carbamoyl]benzoic acid methyl ester Formula: C18H19N3O4S MolecularWeight: 373.42616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NNC(=O)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NNC(=O)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H19N3O4S/c1-24-15-9-3-12(4-10-15)11-19-18(26)21-20-16(22)13-5-7-14(8-6-13)17(23)25-2/h3-10H,11H2,1-2H3,(H,20,22)(H2,19,21,26)