1-(phenylmethyl)-N-(3-phenylsulfanylpropyl)pyrazole-4-carboxamide

Systemtic Name: 1-(phenylmethyl)-N-(3-phenylsulfanylpropyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(3-phenylsulfanylpropyl)pyrazole-4-carboxamide CAS Name: 1-(phenylmethyl)-N-[3-(phenylthio)propyl]-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(3-phenylsulfanylpropyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[3-(phenylthio)propyl]pyrazole-4-carboxamide Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)C(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C20H21N3OS/c24-20(21-12-7-13-25-19-10-5-2-6-11-19)18-14-22-23(16-18)15-17-8-3-1-4-9-17/h1-6,8-11,14,16H,7,12-13,15H2,(H,21,24)