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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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