N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-ethyl-5-methyl-thiophene-2-carboxamide

Systemtic Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-ethyl-5-methyl-thiophene-2-carboxamide Openeye Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-ethyl-5-methyl-thiophene-2-carboxamide CAS Name: N-[2-[(4-bromophenyl)methyl]-3-pyrazolyl]-4-ethyl-5-methyl-2-thiophenecarboxamide IUPAC Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-4-ethyl-5-methylthiophene-2-carboxamide Traditional Name: N-[2-(4-bromobenzyl)pyrazol-3-yl]-4-ethyl-5-methyl-thiophene-2-carboxamide Formula: C18H18BrN3OS MolecularWeight: 404.32402

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1)C(=O)NC2=CC=NN2CC3=CC=C(C=C3)Br)C

Isomeric SMILES

CCC1=C(SC(=C1)C(=O)NC2=CC=NN2CC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C18H18BrN3OS/c1-3-14-10-16(24-12(14)2)18(23)21-17-8-9-20-22(17)11-13-4-6-15(19)7-5-13/h4-10H,3,11H2,1-2H3,(H,21,23)