ethyl 4-[4-(naphthalen-2-ylcarbonylamino)phenyl]sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[4-(naphthalen-2-ylcarbonylamino)phenyl]sulfanyl-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[4-(naphthalene-2-carbonylamino)phenyl]sulfanyl-3-oxo-butanoate CAS Name: 4-[[4-[[2-naphthalenyl(oxo)methyl]amino]phenyl]thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[4-(naphthalene-2-carbonylamino)phenyl]sulfanyl-3-oxobutanoate Traditional Name: 3-keto-4-[[4-(2-naphthoylamino)phenyl]thio]butyric acid ethyl ester Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H21NO4S/c1-2-28-22(26)14-20(25)15-29-21-11-9-19(10-12-21)24-23(27)18-8-7-16-5-3-4-6-17(16)13-18/h3-13H,2,14-15H2,1H3,(H,24,27)