[1-(2-methoxyphenyl)-4-phenyl-6-sulfanylidene-1,3,5-triazin-2-yl] N'-phenylcarbamimidothioate

Systemtic Name: [1-(2-methoxyphenyl)-4-phenyl-6-sulfanylidene-1,3,5-triazin-2-yl] N'-phenylcarbamimidothioate Openeye Name: 2-[1-(2-methoxyphenyl)-4-phenyl-6-thioxo-1,3,5-triazin-2-yl]-3-phenyl-isothiourea CAS Name: N'-phenylcarbamimidothioic acid [1-(2-methoxyphenyl)-4-phenyl-6-sulfanylidene-1,3,5-triazin-2-yl] ester IUPAC Name: [1-(2-methoxyphenyl)-4-phenyl-6-sulfanylidene-1,3,5-triazin-2-yl] N'-phenylcarbamimidothioate Traditional Name: 2-[1-(2-methoxyphenyl)-4-phenyl-6-thioxo-s-triazin-2-yl]-3-phenyl-isothiourea Formula: C23H19N5OS2 MolecularWeight: 445.55986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NC(=NC2=S)C3=CC=CC=C3)SC(=NC4=CC=CC=C4)N

Isomeric SMILES

COC1=CC=CC=C1N2C(=NC(=NC2=S)C3=CC=CC=C3)SC(=NC4=CC=CC=C4)N

InChI

InChI=1S/C23H19N5OS2/c1-29-19-15-9-8-14-18(19)28-22(30)26-20(16-10-4-2-5-11-16)27-23(28)31-21(24)25-17-12-6-3-7-13-17/h2-15H,1H3,(H2,24,25)