4-(azepan-1-ylsulfonyl)-N-[(4-fluorophenyl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[(4-fluorophenyl)methyl]piperazine-1-carboxamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[(4-fluorophenyl)methyl]piperazine-1-carboxamide CAS Name: 4-(1-azepanylsulfonyl)-N-[(4-fluorophenyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[(4-fluorophenyl)methyl]piperazine-1-carboxamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(4-fluorobenzyl)piperazine-1-carboxamide Formula: C18H27FN4O3S MolecularWeight: 398.495383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H27FN4O3S/c19-17-7-5-16(6-8-17)15-20-18(24)21-11-13-23(14-12-21)27(25,26)22-9-3-1-2-4-10-22/h5-8H,1-4,9-15H2,(H,20,24)