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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC(=O)C(S1)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCC(C)NC1=NC(=O)C(S1)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC

InChI

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