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

Systemtic Name: N-(3-fluorophenyl)-4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide Openeye Name: N-(3-fluorophenyl)-4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide CAS Name: N-(3-fluorophenyl)-4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(3-fluorophenyl)-4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-1,4-diazepane-1-carboxamide Traditional Name: 4-[3-(4-fluorobenzyl)-1,2,4-thiadiazol-5-yl]-N-(3-fluorophenyl)-1,4-diazepane-1-carboxamide Formula: C21H21F2N5OS MolecularWeight: 429.486146

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NC2=CC(=CC=C2)F)C3=NC(=NS3)CC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN(C1)C(=O)NC2=CC(=CC=C2)F)C3=NC(=NS3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C21H21F2N5OS/c22-16-7-5-15(6-8-16)13-19-25-21(30-26-19)28-10-2-9-27(11-12-28)20(29)24-18-4-1-3-17(23)14-18/h1,3-8,14H,2,9-13H2,(H,24,29)