3-ethoxy-N-[[2-(4-propan-2-ylphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 3-ethoxy-N-[[2-(4-propan-2-ylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 3-ethoxy-N-[[[2-(4-isopropylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 3-ethoxy-N-[[[1-oxo-2-(4-propan-2-ylphenoxy)ethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-ethoxy-N-[[[2-(4-propan-2-ylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 3-ethoxy-N-[[[2-(4-isopropylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C21H25N3O4S/c1-4-27-18-7-5-6-16(12-18)20(26)22-21(29)24-23-19(25)13-28-17-10-8-15(9-11-17)14(2)3/h5-12,14H,4,13H2,1-3H3,(H,23,25)(H2,22,24,26,29)