2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)-N-[(thiophen-2-ylcarbonylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)-N-[(thiophen-2-ylcarbonylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-[(thiophene-2-carbonylamino)carbamothioyl]acetamide CAS Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-[[[oxo(thiophen-2-yl)methyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-[(thiophene-2-carbonylamino)carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-[(2-thenoylamino)thiocarbamoyl]acetamide Formula: C18H20BrN3O3S2 MolecularWeight: 470.4037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NC(=S)NNC(=O)C2=CC=CS2

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NC(=S)NNC(=O)C2=CC=CS2

InChI

InChI=1S/C18H20BrN3O3S2/c1-10(2)12-8-13(19)11(3)7-14(12)25-9-16(23)20-18(26)22-21-17(24)15-5-4-6-27-15/h4-8,10H,9H2,1-3H3,(H,21,24)(H2,20,22,23,26)