N-(3-phenylpropyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(3-phenylpropyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanamide Openeye Name: N-(3-phenylpropyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetamide CAS Name: N-(3-phenylpropyl)-2-[[4-(1-pyrazolyl)phenyl]methylthio]acetamide IUPAC Name: N-(3-phenylpropyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetamide Traditional Name: N-(3-phenylpropyl)-2-[(4-pyrazol-1-ylbenzyl)thio]acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C21H23N3OS/c25-21(22-13-4-8-18-6-2-1-3-7-18)17-26-16-19-9-11-20(12-10-19)24-15-5-14-23-24/h1-3,5-7,9-12,14-15H,4,8,13,16-17H2,(H,22,25)