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

Systemtic Name: butyl 4-[2-[3-(naphthalen-2-ylcarbonylamino)phenyl]sulfanylethanoylamino]benzoate Openeye Name: butyl 4-[[2-[3-(naphthalene-2-carbonylamino)phenyl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[3-[[2-naphthalenyl(oxo)methyl]amino]phenyl]thio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[3-(naphthalene-2-carbonylamino)phenyl]sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[[3-(2-naphthoylamino)phenyl]thio]acetyl]amino]benzoic acid butyl ester Formula: C30H28N2O4S MolecularWeight: 512.61932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C30H28N2O4S/c1-2-3-17-36-30(35)22-13-15-25(16-14-22)31-28(33)20-37-27-10-6-9-26(19-27)32-29(34)24-12-11-21-7-4-5-8-23(21)18-24/h4-16,18-19H,2-3,17,20H2,1H3,(H,31,33)(H,32,34)