N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(2-chloranyl-5-methyl-phenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(2-chloranyl-5-methyl-phenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(2-chloro-5-methyl-phenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[1-[(4-bromophenyl)methyl]-4-pyrazolyl]-4-[(2-chloro-5-methylphenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-4-[(2-chloro-5-methylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-4-yl]-4-[(2-chloro-5-methyl-phenoxy)methyl]thiophene-2-carboxamide Formula: C23H19BrClN3O2S MolecularWeight: 516.83786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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