ethyl 3-[butyl-[(4-chlorophenyl)carbamothioyl]amino]propanoate

Systemtic Name: ethyl 3-[butyl-[(4-chlorophenyl)carbamothioyl]amino]propanoate Openeye Name: ethyl 3-[butyl-[(4-chlorophenyl)carbamothioyl]amino]propanoate CAS Name: 3-[butyl-[(4-chloroanilino)-sulfanylidenemethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[butyl-[(4-chlorophenyl)carbamothioyl]amino]propanoate Traditional Name: 3-[butyl-[(4-chlorophenyl)thiocarbamoyl]amino]propionic acid ethyl ester Formula: C16H23ClN2O2S MolecularWeight: 342.88402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)OCC)C(=S)NC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCN(CCC(=O)OCC)C(=S)NC1=CC=C(C=C1)Cl

InChI

InChI=1S/C16H23ClN2O2S/c1-3-5-11-19(12-10-15(20)21-4-2)16(22)18-14-8-6-13(17)7-9-14/h6-9H,3-5,10-12H2,1-2H3,(H,18,22)