2-(5-methyl-2-propan-2-yl-phenoxy)-N-[(Z)-1-(4-nitrothiophen-2-yl)ethylideneamino]ethanamide

Systemtic Name: 2-(5-methyl-2-propan-2-yl-phenoxy)-N-[(Z)-1-(4-nitrothiophen-2-yl)ethylideneamino]ethanamide Openeye Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-[(Z)-1-(4-nitro-2-thienyl)ethylideneamino]acetamide CAS Name: 2-(5-methyl-2-propan-2-ylphenoxy)-N-[(Z)-1-(4-nitro-2-thiophenyl)ethylideneamino]acetamide IUPAC Name: 2-(5-methyl-2-propan-2-ylphenoxy)-N-[(Z)-1-(4-nitrothiophen-2-yl)ethylideneamino]acetamide Traditional Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-[(Z)-1-(4-nitro-2-thienyl)ethylideneamino]acetamide Formula: C18H21N3O4S MolecularWeight: 375.44204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NN=C(C)C2=CC(=CS2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)N/N=C(/C)\C2=CC(=CS2)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4S/c1-11(2)15-6-5-12(3)7-16(15)25-9-18(22)20-19-13(4)17-8-14(10-26-17)21(23)24/h5-8,10-11H,9H2,1-4H3,(H,20,22)/b19-13-