N-(2-methoxy-5-methyl-phenyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(2-methoxy-5-methyl-phenyl)-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-(2-methoxy-5-methylphenyl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(2-methoxy-5-methylphenyl)-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(2-methoxy-5-methyl-phenyl)-3-(2-thienyl)pyrazole-4-carboxamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C23H21N3O2S/c1-16-10-11-20(28-2)19(13-16)24-23(27)18-15-26(14-17-7-4-3-5-8-17)25-22(18)21-9-6-12-29-21/h3-13,15H,14H2,1-2H3,(H,24,27)