N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)-2-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)-2-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2-(2-pyrimidinylthio)propanamide IUPAC Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(5-keto-1-phenyl-3-pyrazolin-3-yl)-2-(2-pyrimidylthio)propionamide Formula: C16H15N5O2S MolecularWeight: 341.3876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=O)N(N1)C2=CC=CC=C2)SC3=NC=CC=N3

Isomeric SMILES

CC(C(=O)NC1=CC(=O)N(N1)C2=CC=CC=C2)SC3=NC=CC=N3

InChI

InChI=1S/C16H15N5O2S/c1-11(24-16-17-8-5-9-18-16)15(23)19-13-10-14(22)21(20-13)12-6-3-2-4-7-12/h2-11,20H,1H3,(H,19,23)