3-(4-bromophenyl)-N-(2-morpholin-4-yl-2-thiophen-2-yl-ethyl)-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-bromophenyl)-N-(2-morpholin-4-yl-2-thiophen-2-yl-ethyl)-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-bromophenyl)-N-[2-morpholino-2-(2-thienyl)ethyl]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-bromophenyl)-N-[2-(4-morpholinyl)-2-thiophen-2-ylethyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-bromophenyl)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-bromophenyl)-N-[2-morpholino-2-(2-thienyl)ethyl]-1H-pyrazole-5-carboxamide Formula: C20H21BrN4O2S MolecularWeight: 461.37534

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(CNC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br)C4=CC=CS4

Isomeric SMILES

C1COCCN1C(CNC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Br)C4=CC=CS4

InChI

InChI=1S/C20H21BrN4O2S/c21-15-5-3-14(4-6-15)16-12-17(24-23-16)20(26)22-13-18(19-2-1-11-28-19)25-7-9-27-10-8-25/h1-6,11-12,18H,7-10,13H2,(H,22,26)(H,23,24)