1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-(4-fluorophenyl)pyrrole-2-carboxamide

Systemtic Name: 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-(4-fluorophenyl)pyrrole-2-carboxamide Openeye Name: 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-(4-fluorophenyl)pyrrole-2-carboxamide CAS Name: 1-[5-(1-azepanyl)-1,3,4-thiadiazol-2-yl]-N-(4-fluorophenyl)-2-pyrrolecarboxamide IUPAC Name: 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-(4-fluorophenyl)pyrrole-2-carboxamide Traditional Name: 1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-N-(4-fluorophenyl)pyrrole-2-carboxamide Formula: C19H20FN5OS MolecularWeight: 385.458403

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NN=C(S2)N3C=CC=C3C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(S2)N3C=CC=C3C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C19H20FN5OS/c20-14-7-9-15(10-8-14)21-17(26)16-6-5-13-25(16)19-23-22-18(27-19)24-11-3-1-2-4-12-24/h5-10,13H,1-4,11-12H2,(H,21,26)