N-[1-(phenylmethyl)pyrazol-4-yl]-4-[(2,4,6-trimethylphenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-[1-(phenylmethyl)pyrazol-4-yl]-4-[(2,4,6-trimethylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-(1-benzylpyrazol-4-yl)-4-[(2,4,6-trimethylphenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[1-(phenylmethyl)-4-pyrazolyl]-4-[(2,4,6-trimethylphenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-(1-benzylpyrazol-4-yl)-4-[(2,4,6-trimethylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-(1-benzylpyrazol-4-yl)-4-[(2,4,6-trimethylphenoxy)methyl]thiophene-2-carboxamide Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC2=CSC(=C2)C(=O)NC3=CN(N=C3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC2=CSC(=C2)C(=O)NC3=CN(N=C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H25N3O2S/c1-17-9-18(2)24(19(3)10-17)30-15-21-11-23(31-16-21)25(29)27-22-12-26-28(14-22)13-20-7-5-4-6-8-20/h4-12,14,16H,13,15H2,1-3H3,(H,27,29)