N-[3-(1H-benzimidazol-2-yl)propyl]-4-(2-fluorophenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(2-fluorophenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(2-fluorophenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(2-fluorophenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(2-fluorophenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(2-fluorophenyl)sulfonyl-piperazine-1-carboxamide Formula: C21H24FN5O3S MolecularWeight: 445.510363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCCCC2=NC3=CC=CC=C3N2)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CCN1C(=O)NCCCC2=NC3=CC=CC=C3N2)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C21H24FN5O3S/c22-16-6-1-4-9-19(16)31(29,30)27-14-12-26(13-15-27)21(28)23-11-5-10-20-24-17-7-2-3-8-18(17)25-20/h1-4,6-9H,5,10-15H2,(H,23,28)(H,24,25)