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

Systemtic Name: [1-(2-methoxyphenyl)-4-phenyl-6-sulfanylidene-1,3,5-triazin-2-yl] N'-(3-methylphenyl)carbamimidothioate Openeye Name: 2-[1-(2-methoxyphenyl)-4-phenyl-6-thioxo-1,3,5-triazin-2-yl]-3-(m-tolyl)isothiourea CAS Name: N'-(3-methylphenyl)carbamimidothioic 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'-(3-methylphenyl)carbamimidothioate Traditional Name: 2-[1-(2-methoxyphenyl)-4-phenyl-6-thioxo-s-triazin-2-yl]-3-(m-tolyl)isothiourea Formula: C24H21N5OS2 MolecularWeight: 459.58644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N=C(N)SC2=NC(=NC(=S)N2C3=CC=CC=C3OC)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N=C(N)SC2=NC(=NC(=S)N2C3=CC=CC=C3OC)C4=CC=CC=C4

InChI

InChI=1S/C24H21N5OS2/c1-16-9-8-12-18(15-16)26-22(25)32-24-28-21(17-10-4-3-5-11-17)27-23(31)29(24)19-13-6-7-14-20(19)30-2/h3-15H,1-2H3,(H2,25,26)