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

Systemtic Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-5-methyl-4-propyl-thiophene-2-carboxamide Openeye Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-5-methyl-4-propyl-thiophene-2-carboxamide CAS Name: N-[2-[(4-bromophenyl)methyl]-3-pyrazolyl]-5-methyl-4-propyl-2-thiophenecarboxamide IUPAC Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-5-methyl-4-propylthiophene-2-carboxamide Traditional Name: N-[2-(4-bromobenzyl)pyrazol-3-yl]-5-methyl-4-propyl-thiophene-2-carboxamide Formula: C19H20BrN3OS MolecularWeight: 418.3506

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SC(=C1)C(=O)NC2=CC=NN2CC3=CC=C(C=C3)Br)C

Isomeric SMILES

CCCC1=C(SC(=C1)C(=O)NC2=CC=NN2CC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C19H20BrN3OS/c1-3-4-15-11-17(25-13(15)2)19(24)22-18-9-10-21-23(18)12-14-5-7-16(20)8-6-14/h5-11H,3-4,12H2,1-2H3,(H,22,24)