3-fluoranyl-N-[[5-[(prop-2-enylamino)methyl]-1-propyl-benzimidazol-2-yl]methyl]-N-propyl-benzamide

Systemtic Name: 3-fluoranyl-N-[[5-[(prop-2-enylamino)methyl]-1-propyl-benzimidazol-2-yl]methyl]-N-propyl-benzamide Openeye Name: N-[[5-[(allylamino)methyl]-1-propyl-benzimidazol-2-yl]methyl]-3-fluoro-N-propyl-benzamide CAS Name: 3-fluoro-N-[[5-[(prop-2-enylamino)methyl]-1-propyl-2-benzimidazolyl]methyl]-N-propylbenzamide IUPAC Name: 3-fluoro-N-[[5-[(prop-2-enylamino)methyl]-1-propylbenzimidazol-2-yl]methyl]-N-propylbenzamide Traditional Name: N-[[5-[(allylamino)methyl]-1-propyl-benzimidazol-2-yl]methyl]-3-fluoro-N-propyl-benzamide Formula: C25H31FN4O MolecularWeight: 422.538243

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)CNCC=C)N=C1CN(CCC)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)CNCC=C)N=C1CN(CCC)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C25H31FN4O/c1-4-12-27-17-19-10-11-23-22(15-19)28-24(30(23)14-6-3)18-29(13-5-2)25(31)20-8-7-9-21(26)16-20/h4,7-11,15-16,27H,1,5-6,12-14,17-18H2,2-3H3