2-[3,5-bis(chloranyl)-4-(3-methyl-4-methylsulfanyl-phenoxy)phenyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[3,5-bis(chloranyl)-4-(3-methyl-4-methylsulfanyl-phenoxy)phenyl]-1,2,4-triazine-3,5-dione Openeye Name: 2-[3,5-dichloro-4-(3-methyl-4-methylsulfanyl-phenoxy)phenyl]-1,2,4-triazine-3,5-dione CAS Name: 2-[3,5-dichloro-4-[3-methyl-4-(methylthio)phenoxy]phenyl]-1,2,4-triazine-3,5-dione IUPAC Name: 2-[3,5-dichloro-4-(3-methyl-4-methylsulfanylphenoxy)phenyl]-1,2,4-triazine-3,5-dione Traditional Name: 2-[3,5-dichloro-4-[3-methyl-4-(methylthio)phenoxy]phenyl]-1,2,4-triazine-3,5-quinone Formula: C17H13Cl2N3O3S MolecularWeight: 410.27442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C=C(C=C2Cl)N3C(=O)NC(=O)C=N3)Cl)SC

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C=C(C=C2Cl)N3C(=O)NC(=O)C=N3)Cl)SC

InChI

InChI=1S/C17H13Cl2N3O3S/c1-9-5-11(3-4-14(9)26-2)25-16-12(18)6-10(7-13(16)19)22-17(24)21-15(23)8-20-22/h3-8H,1-2H3,(H,21,23,24)