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

Systemtic Name: [1-(4-methoxyphenyl)-4-phenyl-6-sulfanylidene-1,3,5-triazin-2-yl] N'-(4-methoxyphenyl)carbamimidothioate Openeye Name: 3-(4-methoxyphenyl)-2-[1-(4-methoxyphenyl)-4-phenyl-6-thioxo-1,3,5-triazin-2-yl]isothiourea CAS Name: N'-(4-methoxyphenyl)carbamimidothioic acid [1-(4-methoxyphenyl)-4-phenyl-6-sulfanylidene-1,3,5-triazin-2-yl] ester IUPAC Name: [1-(4-methoxyphenyl)-4-phenyl-6-sulfanylidene-1,3,5-triazin-2-yl] N'-(4-methoxyphenyl)carbamimidothioate Traditional Name: 3-(4-methoxyphenyl)-2-[1-(4-methoxyphenyl)-4-phenyl-6-thioxo-s-triazin-2-yl]isothiourea Formula: C24H21N5O2S2 MolecularWeight: 475.58584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=C(N)SC2=NC(=NC(=S)N2C3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N=C(N)SC2=NC(=NC(=S)N2C3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C24H21N5O2S2/c1-30-19-12-8-17(9-13-19)26-22(25)33-24-28-21(16-6-4-3-5-7-16)27-23(32)29(24)18-10-14-20(31-2)15-11-18/h3-15H,1-2H3,(H2,25,26)