N-(4-bromanyl-2-fluoranyl-phenyl)-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-[5-(4-ethyl-1-piperazinyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1-[5-(4-ethylpiperazino)-1,3,4-thiadiazol-2-yl]pyrrole-2-carboxamide Formula: C19H20BrFN6OS MolecularWeight: 479.369103

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NN=C(S2)N3C=CC=C3C(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

CCN1CCN(CC1)C2=NN=C(S2)N3C=CC=C3C(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C19H20BrFN6OS/c1-2-25-8-10-26(11-9-25)18-23-24-19(29-18)27-7-3-4-16(27)17(28)22-15-6-5-13(20)12-14(15)21/h3-7,12H,2,8-11H2,1H3,(H,22,28)