1-(3-nitrophenyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)pyrazole-3-carboxamide

Systemtic Name: 1-(3-nitrophenyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)pyrazole-3-carboxamide Openeye Name: 1-(3-nitrophenyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)pyrazole-3-carboxamide CAS Name: 1-(3-nitrophenyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-pyrazolecarboxamide IUPAC Name: 1-(3-nitrophenyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)pyrazole-3-carboxamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-1-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C17H18N6O3S MolecularWeight: 386.42822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N6O3S/c1-2-3-4-8-15-19-20-17(27-15)18-16(24)14-9-10-22(21-14)12-6-5-7-13(11-12)23(25)26/h5-7,9-11H,2-4,8H2,1H3,(H,18,20,24)