1-(3-methylsulfanylpropanoyl)-N-(3-pyrazol-1-ylphenyl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(3-methylsulfanylpropanoyl)-N-(3-pyrazol-1-ylphenyl)pyrrolidine-2-carboxamide Openeye Name: 1-(3-methylsulfanylpropanoyl)-N-(3-pyrazol-1-ylphenyl)pyrrolidine-2-carboxamide CAS Name: 1-[3-(methylthio)-1-oxopropyl]-N-[3-(1-pyrazolyl)phenyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(3-methylsulfanylpropanoyl)-N-(3-pyrazol-1-ylphenyl)pyrrolidine-2-carboxamide Traditional Name: 1-[3-(methylthio)propanoyl]-N-(3-pyrazol-1-ylphenyl)pyrrolidine-2-carboxamide Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)N1CCCC1C(=O)NC2=CC=CC(=C2)N3C=CC=N3

Isomeric SMILES

CSCCC(=O)N1CCCC1C(=O)NC2=CC=CC(=C2)N3C=CC=N3

InChI

InChI=1S/C18H22N4O2S/c1-25-12-8-17(23)21-10-3-7-16(21)18(24)20-14-5-2-6-15(13-14)22-11-4-9-19-22/h2,4-6,9,11,13,16H,3,7-8,10,12H2,1H3,(H,20,24)