ethyl 4-[2-[3-(naphthalen-2-ylcarbonylamino)phenyl]sulfanylpropanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[3-(naphthalen-2-ylcarbonylamino)phenyl]sulfanylpropanoylamino]benzoate Openeye Name: ethyl 4-[2-[3-(naphthalene-2-carbonylamino)phenyl]sulfanylpropanoylamino]benzoate CAS Name: 4-[[2-[[3-[[2-naphthalenyl(oxo)methyl]amino]phenyl]thio]-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-(naphthalene-2-carbonylamino)phenyl]sulfanylpropanoylamino]benzoate Traditional Name: 4-[2-[[3-(2-naphthoylamino)phenyl]thio]propanoylamino]benzoic acid ethyl ester Formula: C29H26N2O4S MolecularWeight: 498.59274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H26N2O4S/c1-3-35-29(34)21-13-15-24(16-14-21)30-27(32)19(2)36-26-10-6-9-25(18-26)31-28(33)23-12-11-20-7-4-5-8-22(20)17-23/h4-19H,3H2,1-2H3,(H,30,32)(H,31,33)