1-(1H-indol-3-yl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(1H-indol-3-yl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(1H-indol-3-yl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(1H-indol-3-yl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(1H-indol-3-yl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(1H-indol-3-yl)-2-(2-pyrimidylthio)ethanone Formula: C14H11N3OS MolecularWeight: 269.32164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C(=O)CSC3=NC=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C14H11N3OS/c18-13(9-19-14-15-6-3-7-16-14)11-8-17-12-5-2-1-4-10(11)12/h1-8,17H,9H2