3-(2-methoxyphenyl)-1-(phenylmethyl)-N-(2-phenylsulfanylethyl)pyrazole-4-carboxamide

Systemtic Name: 3-(2-methoxyphenyl)-1-(phenylmethyl)-N-(2-phenylsulfanylethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-3-(2-methoxyphenyl)-N-(2-phenylsulfanylethyl)pyrazole-4-carboxamide CAS Name: 3-(2-methoxyphenyl)-1-(phenylmethyl)-N-[2-(phenylthio)ethyl]-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-3-(2-methoxyphenyl)-N-(2-phenylsulfanylethyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-3-(2-methoxyphenyl)-N-[2-(phenylthio)ethyl]pyrazole-4-carboxamide Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN(C=C2C(=O)NCCSC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C2=NN(C=C2C(=O)NCCSC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O2S/c1-31-24-15-9-8-14-22(24)25-23(19-29(28-25)18-20-10-4-2-5-11-20)26(30)27-16-17-32-21-12-6-3-7-13-21/h2-15,19H,16-18H2,1H3,(H,27,30)