N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[1-[(4-bromophenyl)methyl]-4-pyrazolyl]-4-[(3-methylphenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-4-yl]-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide Formula: C23H20BrN3O2S MolecularWeight: 482.3928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20BrN3O2S/c1-16-3-2-4-21(9-16)29-14-18-10-22(30-15-18)23(28)26-20-11-25-27(13-20)12-17-5-7-19(24)8-6-17/h2-11,13,15H,12,14H2,1H3,(H,26,28)