2-[2-(butylamino)-4-oxidanylidene-1,3-thiazol-5-yl]-N-(2-methoxy-5-nitro-phenyl)ethanamide

Systemtic Name: 2-[2-(butylamino)-4-oxidanylidene-1,3-thiazol-5-yl]-N-(2-methoxy-5-nitro-phenyl)ethanamide Openeye Name: 2-[2-(butylamino)-4-oxo-thiazol-5-yl]-N-(2-methoxy-5-nitro-phenyl)acetamide CAS Name: 2-[2-(butylamino)-4-oxo-5-thiazolyl]-N-(2-methoxy-5-nitrophenyl)acetamide IUPAC Name: 2-[2-(butylamino)-4-oxo-1,3-thiazol-5-yl]-N-(2-methoxy-5-nitrophenyl)acetamide Traditional Name: 2-[2-(butylamino)-4-keto-2-thiazolin-5-yl]-N-(2-methoxy-5-nitro-phenyl)acetamide Formula: C16H20N4O5S MolecularWeight: 380.4188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=O)C(S1)CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCCCNC1=NC(=O)C(S1)CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C16H20N4O5S/c1-3-4-7-17-16-19-15(22)13(26-16)9-14(21)18-11-8-10(20(23)24)5-6-12(11)25-2/h5-6,8,13H,3-4,7,9H2,1-2H3,(H,18,21)(H,17,19,22)