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

Systemtic Name: methyl 2-[2-[4-(naphthalen-2-ylcarbonylamino)phenyl]sulfanylethanoylamino]benzoate Openeye Name: methyl 2-[[2-[4-(naphthalene-2-carbonylamino)phenyl]sulfanylacetyl]amino]benzoate CAS Name: 2-[[2-[[4-[[2-naphthalenyl(oxo)methyl]amino]phenyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(naphthalene-2-carbonylamino)phenyl]sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[[4-(2-naphthoylamino)phenyl]thio]acetyl]amino]benzoic acid methyl ester Formula: C27H22N2O4S MolecularWeight: 470.53958

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CSC2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CSC2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H22N2O4S/c1-33-27(32)23-8-4-5-9-24(23)29-25(30)17-34-22-14-12-21(13-15-22)28-26(31)20-11-10-18-6-2-3-7-19(18)16-20/h2-16H,17H2,1H3,(H,28,31)(H,29,30)