(2S)-N-(1-methylpyrazol-3-yl)-2-phenylsulfanyl-propanamide

Systemtic Name: (2S)-N-(1-methylpyrazol-3-yl)-2-phenylsulfanyl-propanamide Openeye Name: (2S)-N-(1-methylpyrazol-3-yl)-2-phenylsulfanyl-propanamide CAS Name: (2S)-N-(1-methyl-3-pyrazolyl)-2-(phenylthio)propanamide IUPAC Name: (2S)-N-(1-methylpyrazol-3-yl)-2-phenylsulfanylpropanamide Traditional Name: (2S)-N-(1-methylpyrazol-3-yl)-2-(phenylthio)propionamide Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NN(C=C1)C)SC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NC1=NN(C=C1)C)SC2=CC=CC=C2

InChI

InChI=1S/C13H15N3OS/c1-10(18-11-6-4-3-5-7-11)13(17)14-12-8-9-16(2)15-12/h3-10H,1-2H3,(H,14,15,17)/t10-/m0/s1