N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-4-butoxy-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: N-[4,6-bis(fluoranyl)-1,3-benzothiazol-2-yl]-4-butoxy-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-butoxy-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)benzamide CAS Name: 4-butoxy-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-butoxy-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-butoxy-N-(4,6-difluoro-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)benzamide Formula: C24H21F2N3O2S MolecularWeight: 453.504246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N(CC2=CN=CC=C2)C3=NC4=C(C=C(C=C4S3)F)F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N(CC2=CN=CC=C2)C3=NC4=C(C=C(C=C4S3)F)F

InChI

InChI=1S/C24H21F2N3O2S/c1-2-3-11-31-19-8-6-17(7-9-19)23(30)29(15-16-5-4-10-27-14-16)24-28-22-20(26)12-18(25)13-21(22)32-24/h4-10,12-14H,2-3,11,15H2,1H3