5-cyclopropyl-2-phenyl-N-(2-prop-2-enylsulfanylphenyl)pyrazole-3-carboxamide

Systemtic Name: 5-cyclopropyl-2-phenyl-N-(2-prop-2-enylsulfanylphenyl)pyrazole-3-carboxamide Openeye Name: N-(2-allylsulfanylphenyl)-5-cyclopropyl-2-phenyl-pyrazole-3-carboxamide CAS Name: 5-cyclopropyl-2-phenyl-N-[2-(prop-2-enylthio)phenyl]-3-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-2-phenyl-N-(2-prop-2-enylsulfanylphenyl)pyrazole-3-carboxamide Traditional Name: N-[2-(allylthio)phenyl]-5-cyclopropyl-2-phenyl-pyrazole-3-carboxamide Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NC(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

Isomeric SMILES

C=CCSC1=CC=CC=C1NC(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C22H21N3OS/c1-2-14-27-21-11-7-6-10-18(21)23-22(26)20-15-19(16-12-13-16)24-25(20)17-8-4-3-5-9-17/h2-11,15-16H,1,12-14H2,(H,23,26)