4-[(3,4-dimethylphenoxy)methyl]-N-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiophene-2-carboxamide

Systemtic Name: 4-[(3,4-dimethylphenoxy)methyl]-N-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiophene-2-carboxamide Openeye Name: 4-[(3,4-dimethylphenoxy)methyl]-N-[1-(1-naphthylmethyl)pyrazol-4-yl]thiophene-2-carboxamide CAS Name: 4-[(3,4-dimethylphenoxy)methyl]-N-[1-(1-naphthalenylmethyl)-4-pyrazolyl]-2-thiophenecarboxamide IUPAC Name: 4-[(3,4-dimethylphenoxy)methyl]-N-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiophene-2-carboxamide Traditional Name: 4-[(3,4-dimethylphenoxy)methyl]-N-[1-(1-naphthylmethyl)pyrazol-4-yl]thiophene-2-carboxamide Formula: C28H25N3O2S MolecularWeight: 467.582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=CSC(=C2)C(=O)NC3=CN(N=C3)CC4=CC=CC5=CC=CC=C54)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=CSC(=C2)C(=O)NC3=CN(N=C3)CC4=CC=CC5=CC=CC=C54)C

InChI

InChI=1S/C28H25N3O2S/c1-19-10-11-25(12-20(19)2)33-17-21-13-27(34-18-21)28(32)30-24-14-29-31(16-24)15-23-8-5-7-22-6-3-4-9-26(22)23/h3-14,16,18H,15,17H2,1-2H3,(H,30,32)