N-[[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoylamino]carbamothioyl]-2-naphthalen-1-yl-ethanamide

Systemtic Name: N-[[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoylamino]carbamothioyl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]amino]carbamothioyl]-2-(1-naphthyl)acetamide CAS Name: N-[[[2-(5-methyl-2-propan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]carbamothioyl]-2-naphthalen-1-ylacetamide Traditional Name: N-[[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]amino]thiocarbamoyl]-2-(1-naphthyl)acetamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NNC(=S)NC(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NNC(=S)NC(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C25H27N3O3S/c1-16(2)20-12-11-17(3)13-22(20)31-15-24(30)27-28-25(32)26-23(29)14-19-9-6-8-18-7-4-5-10-21(18)19/h4-13,16H,14-15H2,1-3H3,(H,27,30)(H2,26,28,29,32)