1-(benzotriazol-1-yl)-3-phenylsulfanyl-propan-2-one

Systemtic Name: 1-(benzotriazol-1-yl)-3-phenylsulfanyl-propan-2-one Openeye Name: 1-(benzotriazol-1-yl)-3-phenylsulfanyl-propan-2-one CAS Name: 1-(1-benzotriazolyl)-3-(phenylthio)-2-propanone IUPAC Name: 1-(benzotriazol-1-yl)-3-phenylsulfanylpropan-2-one Traditional Name: 1-(benzotriazol-1-yl)-3-(phenylthio)acetone Formula: C15H13N3OS MolecularWeight: 283.34822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C15H13N3OS/c19-12(11-20-13-6-2-1-3-7-13)10-18-15-9-5-4-8-14(15)16-17-18/h1-9H,10-11H2