ethyl 4-[4-(4-chlorophenyl)sulfanylbutanoylamino]benzoate

Systemtic Name: ethyl 4-[4-(4-chlorophenyl)sulfanylbutanoylamino]benzoate Openeye Name: ethyl 4-[4-(4-chlorophenyl)sulfanylbutanoylamino]benzoate CAS Name: 4-[[4-[(4-chlorophenyl)thio]-1-oxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-chlorophenyl)sulfanylbutanoylamino]benzoate Traditional Name: 4-[4-[(4-chlorophenyl)thio]butanoylamino]benzoic acid ethyl ester Formula: C19H20ClNO3S MolecularWeight: 377.885

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H20ClNO3S/c1-2-24-19(23)14-5-9-16(10-6-14)21-18(22)4-3-13-25-17-11-7-15(20)8-12-17/h5-12H,2-4,13H2,1H3,(H,21,22)