5-(4-bromophenyl)-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(4-bromophenyl)-N-[2-(2-thienylmethyl)pyrazol-3-yl]isoxazole-3-carboxamide CAS Name: 5-(4-bromophenyl)-N-[2-(thiophen-2-ylmethyl)-3-pyrazolyl]-3-isoxazolecarboxamide IUPAC Name: 5-(4-bromophenyl)-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(4-bromophenyl)-N-[2-(2-thenyl)pyrazol-3-yl]isoxazole-3-carboxamide Formula: C18H13BrN4O2S MolecularWeight: 429.29042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CN2C(=CC=N2)NC(=O)C3=NOC(=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CSC(=C1)CN2C(=CC=N2)NC(=O)C3=NOC(=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C18H13BrN4O2S/c19-13-5-3-12(4-6-13)16-10-15(22-25-16)18(24)21-17-7-8-20-23(17)11-14-2-1-9-26-14/h1-10H,11H2,(H,21,24)