6-azanyl-5-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-2H-1,2,4-triazin-3-one

Systemtic Name: 6-azanyl-5-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-2H-1,2,4-triazin-3-one Openeye Name: 6-amino-5-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-2H-1,2,4-triazin-3-one CAS Name: 6-amino-5-[[2-oxo-2-(4-phenylphenyl)ethyl]thio]-2H-1,2,4-triazin-3-one IUPAC Name: 6-amino-5-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-2H-1,2,4-triazin-3-one Traditional Name: 6-amino-5-[[2-keto-2-(4-phenylphenyl)ethyl]thio]-2H-1,2,4-triazin-3-one Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CSC3=NC(=O)NN=C3N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CSC3=NC(=O)NN=C3N

InChI

InChI=1S/C17H14N4O2S/c18-15-16(19-17(23)21-20-15)24-10-14(22)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9H,10H2,(H2,18,20)(H,19,21,23)