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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NC(=NC2=S)C3=CC=CC=C3)SC(=NC4=CC=CC=C4)N

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NC(=NC2=S)C3=CC=CC=C3)SC(=NC4=CC=CC=C4)N

InChI

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