2-(4-chloranylphenoxy)-2-methyl-N-[4-(propanoylcarbamothioylamino)phenyl]propanamide

Systemtic Name: 2-(4-chloranylphenoxy)-2-methyl-N-[4-(propanoylcarbamothioylamino)phenyl]propanamide Openeye Name: 2-(4-chlorophenoxy)-2-methyl-N-[4-(propanoylcarbamothioylamino)phenyl]propanamide CAS Name: 2-(4-chlorophenoxy)-2-methyl-N-[4-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]phenyl]propanamide IUPAC Name: 2-(4-chlorophenoxy)-2-methyl-N-[4-(propanoylcarbamothioylamino)phenyl]propanamide Traditional Name: 2-(4-chlorophenoxy)-2-methyl-N-[4-(propionylthiocarbamoylamino)phenyl]propionamide Formula: C20H22ClN3O3S MolecularWeight: 419.92498

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C(C)(C)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C(C)(C)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H22ClN3O3S/c1-4-17(25)24-19(28)23-15-9-7-14(8-10-15)22-18(26)20(2,3)27-16-11-5-13(21)6-12-16/h5-12H,4H2,1-3H3,(H,22,26)(H2,23,24,25,28)