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

Systemtic Name: 4-methoxy-3-nitro-N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-methoxy-N-[5-(1-methylbutyl)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide CAS Name: 4-methoxy-3-nitro-N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-methoxy-3-nitro-N-(5-pentan-2-yl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-methoxy-N-[5-(1-methylbutyl)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide Formula: C15H18N4O4S MolecularWeight: 350.39282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O4S/c1-4-5-9(2)14-17-18-15(24-14)16-13(20)10-6-7-12(23-3)11(8-10)19(21)22/h6-9H,4-5H2,1-3H3,(H,16,18,20)