(2R)-2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1,2-diphenyl-ethanone

Systemtic Name: (2R)-2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1,2-diphenyl-ethanone Openeye Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1,2-diphenyl-ethanone CAS Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1,2-diphenylethanone IUPAC Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1,2-diphenylethanone Traditional Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1,2-diphenyl-ethanone Formula: C16H14N4OS MolecularWeight: 310.37356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)SC3=NNC(=N3)N

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C(=O)C2=CC=CC=C2)SC3=NNC(=N3)N

InChI

InChI=1S/C16H14N4OS/c17-15-18-16(20-19-15)22-14(12-9-5-2-6-10-12)13(21)11-7-3-1-4-8-11/h1-10,14H,(H3,17,18,19,20)/t14-/m1/s1