N-[[2-(3-methylphenoxy)ethanoylamino]carbamothioyl]-3-phenethyloxy-benzamide

Systemtic Name: N-[[2-(3-methylphenoxy)ethanoylamino]carbamothioyl]-3-phenethyloxy-benzamide Openeye Name: N-[[[2-(3-methylphenoxy)acetyl]amino]carbamothioyl]-3-phenethyloxy-benzamide CAS Name: N-[[[2-(3-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-phenethyloxybenzamide IUPAC Name: N-[[[2-(3-methylphenoxy)acetyl]amino]carbamothioyl]-3-phenethyloxybenzamide Traditional Name: N-[[[2-(3-methylphenoxy)acetyl]amino]thiocarbamoyl]-3-phenethyloxy-benzamide Formula: C25H25N3O4S MolecularWeight: 463.5487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C25H25N3O4S/c1-18-7-5-11-21(15-18)32-17-23(29)27-28-25(33)26-24(30)20-10-6-12-22(16-20)31-14-13-19-8-3-2-4-9-19/h2-12,15-16H,13-14,17H2,1H3,(H,27,29)(H2,26,28,30,33)