N-[1-(4-methylsulfanylphenyl)ethyl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[1-(4-methylsulfanylphenyl)ethyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[1-(4-methylsulfanylphenyl)ethyl]pyrazole-4-carboxamide CAS Name: N-[1-[4-(methylthio)phenyl]ethyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[1-(4-methylsulfanylphenyl)ethyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[1-[4-(methylthio)phenyl]ethyl]pyrazole-4-carboxamide Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)SC)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=C(C=C1)SC)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H21N3OS/c1-15(17-8-10-19(25-2)11-9-17)22-20(24)18-12-21-23(14-18)13-16-6-4-3-5-7-16/h3-12,14-15H,13H2,1-2H3,(H,22,24)