2-[3-chloranyl-4-(4-methylsulfanylphenoxy)phenyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[3-chloranyl-4-(4-methylsulfanylphenoxy)phenyl]-1,2,4-triazine-3,5-dione Openeye Name: 2-[3-chloro-4-(4-methylsulfanylphenoxy)phenyl]-1,2,4-triazine-3,5-dione CAS Name: 2-[3-chloro-4-[4-(methylthio)phenoxy]phenyl]-1,2,4-triazine-3,5-dione IUPAC Name: 2-[3-chloro-4-(4-methylsulfanylphenoxy)phenyl]-1,2,4-triazine-3,5-dione Traditional Name: 2-[3-chloro-4-[4-(methylthio)phenoxy]phenyl]-1,2,4-triazine-3,5-quinone Formula: C16H12ClN3O3S MolecularWeight: 361.80278

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)OC2=C(C=C(C=C2)N3C(=O)NC(=O)C=N3)Cl

Isomeric SMILES

CSC1=CC=C(C=C1)OC2=C(C=C(C=C2)N3C(=O)NC(=O)C=N3)Cl

InChI

InChI=1S/C16H12ClN3O3S/c1-24-12-5-3-11(4-6-12)23-14-7-2-10(8-13(14)17)20-16(22)19-15(21)9-18-20/h2-9H,1H3,(H,19,21,22)