butyl 4-[2-[3-(naphthalen-2-ylcarbonylamino)phenyl]sulfanylbutanoylamino]benzoate

Systemtic Name: butyl 4-[2-[3-(naphthalen-2-ylcarbonylamino)phenyl]sulfanylbutanoylamino]benzoate Openeye Name: butyl 4-[2-[3-(naphthalene-2-carbonylamino)phenyl]sulfanylbutanoylamino]benzoate CAS Name: 4-[[2-[[3-[[2-naphthalenyl(oxo)methyl]amino]phenyl]thio]-1-oxobutyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[2-[3-(naphthalene-2-carbonylamino)phenyl]sulfanylbutanoylamino]benzoate Traditional Name: 4-[2-[[3-(2-naphthoylamino)phenyl]thio]butanoylamino]benzoic acid butyl ester Formula: C32H32N2O4S MolecularWeight: 540.67248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H32N2O4S/c1-3-5-19-38-32(37)23-15-17-26(18-16-23)33-31(36)29(4-2)39-28-12-8-11-27(21-28)34-30(35)25-14-13-22-9-6-7-10-24(22)20-25/h6-18,20-21,29H,3-5,19H2,1-2H3,(H,33,36)(H,34,35)