N-(4-fluoranyl-1,3-benzothiazol-2-yl)-3-nitro-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: N-(4-fluoranyl-1,3-benzothiazol-2-yl)-3-nitro-N-(pyridin-3-ylmethyl)benzamide Openeye Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-3-nitro-N-(3-pyridylmethyl)benzamide CAS Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-3-nitro-N-(3-pyridinylmethyl)benzamide IUPAC Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-3-nitro-N-(pyridin-3-ylmethyl)benzamide Traditional Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-3-nitro-N-(3-pyridylmethyl)benzamide Formula: C20H13FN4O3S MolecularWeight: 408.405623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N(CC2=CN=CC=C2)C3=NC4=C(C=CC=C4S3)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N(CC2=CN=CC=C2)C3=NC4=C(C=CC=C4S3)F

InChI

InChI=1S/C20H13FN4O3S/c21-16-7-2-8-17-18(16)23-20(29-17)24(12-13-4-3-9-22-11-13)19(26)14-5-1-6-15(10-14)25(27)28/h1-11H,12H2