5-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-2-piperidin-1-yl-benzamide

Systemtic Name: 5-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-2-piperidin-1-yl-benzamide Openeye Name: 5-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-2-(1-piperidyl)benzamide CAS Name: 5-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-2-(1-piperidinyl)benzamide IUPAC Name: 5-nitro-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-2-piperidin-1-ylbenzamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-5-nitro-2-piperidino-benzamide Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C19H25N5O3S/c1-2-3-5-8-17-21-22-19(28-17)20-18(25)15-13-14(24(26)27)9-10-16(15)23-11-6-4-7-12-23/h9-10,13H,2-8,11-12H2,1H3,(H,20,22,25)