1-phenyl-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one

Systemtic Name: 1-phenyl-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: 1-phenyl-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one CAS Name: 1-phenyl-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: 1-phenyl-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: 1-phenyl-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propan-1-one Formula: C17H15N3OS MolecularWeight: 309.3855

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)SC2=NN=CN2C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)SC2=NN=CN2C3=CC=CC=C3

InChI

InChI=1S/C17H15N3OS/c1-13(16(21)14-8-4-2-5-9-14)22-17-19-18-12-20(17)15-10-6-3-7-11-15/h2-13H,1H3