2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenoxyphenyl)ethanone

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenoxyphenyl)ethanone Openeye Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenoxyphenyl)ethanone CAS Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-1-(4-phenoxyphenyl)ethanone IUPAC Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenoxyphenyl)ethanone Traditional Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-1-(4-phenoxyphenyl)ethanone Formula: C16H14N4O2S MolecularWeight: 326.37296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)CSC3=NN=CN3N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)CSC3=NN=CN3N

InChI

InChI=1S/C16H14N4O2S/c17-20-11-18-19-16(20)23-10-15(21)12-6-8-14(9-7-12)22-13-4-2-1-3-5-13/h1-9,11H,10,17H2