4-(azepan-1-ylcarbonyl)-N-(4-fluorophenyl)piperidine-1-carbothioamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N-(4-fluorophenyl)piperidine-1-carbothioamide Openeye Name: 4-(azepane-1-carbonyl)-N-(4-fluorophenyl)piperidine-1-carbothioamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N-(4-fluorophenyl)-1-piperidinecarbothioamide IUPAC Name: 4-(azepane-1-carbonyl)-N-(4-fluorophenyl)piperidine-1-carbothioamide Traditional Name: 4-(azepane-1-carbonyl)-N-(4-fluorophenyl)piperidine-1-carbothioamide Formula: C19H26FN3OS MolecularWeight: 363.492643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=S)NC3=CC=C(C=C3)F

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=S)NC3=CC=C(C=C3)F

InChI

InChI=1S/C19H26FN3OS/c20-16-5-7-17(8-6-16)21-19(25)23-13-9-15(10-14-23)18(24)22-11-3-1-2-4-12-22/h5-8,15H,1-4,9-14H2,(H,21,25)