N-(6-fluoranyl-1,3-benzothiazol-2-yl)-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C20H19FN4O3S MolecularWeight: 414.453263

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C20H19FN4O3S/c1-12-6-8-24(9-7-12)16-5-2-13(10-17(16)25(27)28)19(26)23-20-22-15-4-3-14(21)11-18(15)29-20/h2-5,10-12H,6-9H2,1H3,(H,22,23,26)