2-[3-chloranyl-4-(4-chlorophenyl)carbonyl-5-methyl-phenyl]-5-sulfanylidene-1,2,4-triazin-3-one

Systemtic Name: 2-[3-chloranyl-4-(4-chlorophenyl)carbonyl-5-methyl-phenyl]-5-sulfanylidene-1,2,4-triazin-3-one Openeye Name: 2-[3-chloro-4-(4-chlorobenzoyl)-5-methyl-phenyl]-5-thioxo-1,2,4-triazin-3-one CAS Name: 2-[3-chloro-4-[(4-chlorophenyl)-oxomethyl]-5-methylphenyl]-5-sulfanylidene-1,2,4-triazin-3-one IUPAC Name: 2-[3-chloro-4-(4-chlorobenzoyl)-5-methylphenyl]-5-sulfanylidene-1,2,4-triazin-3-one Traditional Name: 2-[3-chloro-4-(4-chlorobenzoyl)-5-methyl-phenyl]-5-thioxo-1,2,4-triazin-3-one Formula: C17H11Cl2N3O2S MolecularWeight: 392.25914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(=O)C2=CC=C(C=C2)Cl)Cl)N3C(=O)NC(=S)C=N3

Isomeric SMILES

CC1=CC(=CC(=C1C(=O)C2=CC=C(C=C2)Cl)Cl)N3C(=O)NC(=S)C=N3

InChI

InChI=1S/C17H11Cl2N3O2S/c1-9-6-12(22-17(24)21-14(25)8-20-22)7-13(19)15(9)16(23)10-2-4-11(18)5-3-10/h2-8H,1H3,(H,21,24,25)