butyl 4-[[2-[4-[(3-methoxyphenyl)carbonylamino]phenyl]sulfanyl-2-phenyl-ethanoyl]amino]benzoate

Systemtic Name: butyl 4-[[2-[4-[(3-methoxyphenyl)carbonylamino]phenyl]sulfanyl-2-phenyl-ethanoyl]amino]benzoate Openeye Name: butyl 4-[[2-[4-[(3-methoxybenzoyl)amino]phenyl]sulfanyl-2-phenyl-acetyl]amino]benzoate CAS Name: 4-[[2-[[4-[[(3-methoxyphenyl)-oxomethyl]amino]phenyl]thio]-1-oxo-2-phenylethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[4-[(3-methoxybenzoyl)amino]phenyl]sulfanyl-2-phenylacetyl]amino]benzoate Traditional Name: 4-[[2-[[4-(m-anisoylamino)phenyl]thio]-2-phenyl-acetyl]amino]benzoic acid butyl ester Formula: C33H32N2O5S MolecularWeight: 568.68258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C33H32N2O5S/c1-3-4-21-40-33(38)24-13-15-26(16-14-24)35-32(37)30(23-9-6-5-7-10-23)41-29-19-17-27(18-20-29)34-31(36)25-11-8-12-28(22-25)39-2/h5-20,22,30H,3-4,21H2,1-2H3,(H,34,36)(H,35,37)