N-butyl-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-butyl-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-butyl-N-[4-(4-fluorophenyl)thiazol-2-yl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-butyl-N-[4-(4-fluorophenyl)-2-thiazolyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-butyl-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-butyl-N-[4-(4-fluorophenyl)thiazol-2-yl]-3-nitro-4-piperidino-benzamide Formula: C25H27FN4O3S MolecularWeight: 482.570283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NC(=CS1)C2=CC=C(C=C2)F)C(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CCCCN(C1=NC(=CS1)C2=CC=C(C=C2)F)C(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C25H27FN4O3S/c1-2-3-15-29(25-27-21(17-34-25)18-7-10-20(26)11-8-18)24(31)19-9-12-22(23(16-19)30(32)33)28-13-5-4-6-14-28/h7-12,16-17H,2-6,13-15H2,1H3