N-[[4-[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]phenyl]carbamothioyl]propanamide

Systemtic Name: N-[[4-[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]phenyl]carbamothioyl]propanamide Openeye Name: N-[[4-[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]phenyl]carbamothioyl]propanamide CAS Name: N-[[4-[[2-(4-chloro-3-methylphenoxy)-1-oxoethyl]amino]anilino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[[4-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]phenyl]carbamothioyl]propanamide Traditional Name: N-[[4-[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]phenyl]thiocarbamoyl]propionamide Formula: C19H20ClN3O3S MolecularWeight: 405.8984

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)COC2=CC(=C(C=C2)Cl)C

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)COC2=CC(=C(C=C2)Cl)C

InChI

InChI=1S/C19H20ClN3O3S/c1-3-17(24)23-19(27)22-14-6-4-13(5-7-14)21-18(25)11-26-15-8-9-16(20)12(2)10-15/h4-10H,3,11H2,1-2H3,(H,21,25)(H2,22,23,24,27)