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

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(4-chloranyl-3-methyl-phenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(4-chloro-3-methyl-phenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[1-[(4-bromophenyl)methyl]-4-pyrazolyl]-4-[(4-chloro-3-methylphenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(4-chloro-3-methylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-4-yl]-4-[(4-chloro-3-methyl-phenoxy)methyl]thiophene-2-carboxamide Formula: C23H19BrClN3O2S MolecularWeight: 516.83786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19BrClN3O2S/c1-15-8-20(6-7-21(15)25)30-13-17-9-22(31-14-17)23(29)27-19-10-26-28(12-19)11-16-2-4-18(24)5-3-16/h2-10,12,14H,11,13H2,1H3,(H,27,29)