N-[[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]carbamothioyl]-4-propan-2-yloxy-benzamide

Systemtic Name: N-[[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]carbamothioyl]-4-propan-2-yloxy-benzamide Openeye Name: N-[[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]carbamothioyl]-4-isopropoxy-benzamide CAS Name: N-[[[2-(4-chloro-3-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-propan-2-yloxybenzamide IUPAC Name: N-[[[2-(4-chloro-3-methylphenoxy)acetyl]amino]carbamothioyl]-4-propan-2-yloxybenzamide Traditional Name: N-[[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]thiocarbamoyl]-4-isopropoxy-benzamide Formula: C20H22ClN3O4S MolecularWeight: 435.92438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)OC(C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)OC(C)C)Cl

InChI

InChI=1S/C20H22ClN3O4S/c1-12(2)28-15-6-4-14(5-7-15)19(26)22-20(29)24-23-18(25)11-27-16-8-9-17(21)13(3)10-16/h4-10,12H,11H2,1-3H3,(H,23,25)(H2,22,24,26,29)