4-morpholin-4-yl-3-nitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-morpholin-4-yl-3-nitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-morpholino-3-nitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-(4-morpholinyl)-3-nitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-morpholin-4-yl-3-nitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-morpholino-3-nitro-N-(5-propyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C16H19N5O4S MolecularWeight: 377.41816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O4S/c1-2-3-14-18-19-16(26-14)17-15(22)11-4-5-12(13(10-11)21(23)24)20-6-8-25-9-7-20/h4-5,10H,2-3,6-9H2,1H3,(H,17,19,22)