2-(methylamino)-5-nitro-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 2-(methylamino)-5-nitro-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-2-(methylamino)-5-nitro-benzamide CAS Name: 2-(methylamino)-5-nitro-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 2-(methylamino)-5-nitro-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-2-(methylamino)-5-nitro-benzamide Formula: C15H19N5O3S MolecularWeight: 349.40806

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC

InChI

InChI=1S/C15H19N5O3S/c1-4-9(5-2)14-18-19-15(24-14)17-13(21)11-8-10(20(22)23)6-7-12(11)16-3/h6-9,16H,4-5H2,1-3H3,(H,17,19,21)