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

Systemtic Name: 2-[4-(3-methyl-4-methylsulfanyl-phenoxy)phenyl]-1,2,4-triazinane-3,5-dione Openeye Name: 2-[4-(3-methyl-4-methylsulfanyl-phenoxy)phenyl]-1,2,4-triazinane-3,5-dione CAS Name: 2-[4-[3-methyl-4-(methylthio)phenoxy]phenyl]-1,2,4-triazinane-3,5-dione IUPAC Name: 2-[4-(3-methyl-4-methylsulfanylphenoxy)phenyl]-1,2,4-triazinane-3,5-dione Traditional Name: 2-[4-[3-methyl-4-(methylthio)phenoxy]phenyl]-1,2,4-triazinane-3,5-quinone Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC=C(C=C2)N3C(=O)NC(=O)CN3)SC

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC=C(C=C2)N3C(=O)NC(=O)CN3)SC

InChI

InChI=1S/C17H17N3O3S/c1-11-9-14(7-8-15(11)24-2)23-13-5-3-12(4-6-13)20-17(22)19-16(21)10-18-20/h3-9,18H,10H2,1-2H3,(H,19,21,22)