5-cyclopropyl-N-[2-(phenylmethylsulfanyl)ethyl]-1H-pyrazole-3-carboxamide

Systemtic Name: 5-cyclopropyl-N-[2-(phenylmethylsulfanyl)ethyl]-1H-pyrazole-3-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-5-cyclopropyl-1H-pyrazole-3-carboxamide CAS Name: 5-cyclopropyl-N-[2-(phenylmethylthio)ethyl]-1H-pyrazole-3-carboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-5-cyclopropyl-1H-pyrazole-3-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2)C(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

C1CC1C2=CC(=NN2)C(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C16H19N3OS/c20-16(15-10-14(18-19-15)13-6-7-13)17-8-9-21-11-12-4-2-1-3-5-12/h1-5,10,13H,6-9,11H2,(H,17,20)(H,18,19)