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

Systemtic Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(4-fluorophenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(4-fluorophenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(4-fluorophenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(4-fluorophenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-[3-(1H-benzimidazol-2-yl)propyl]-4-(4-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=C(C=C4)F

Isomeric SMILES

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

InChI

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