ethyl 3-[3-[(3-aminophenyl)sulfonylamino]phenyl]-3-(2-phenylbutanoylamino)propanoate

Systemtic Name: ethyl 3-[3-[(3-aminophenyl)sulfonylamino]phenyl]-3-(2-phenylbutanoylamino)propanoate Openeye Name: ethyl 3-[3-[(3-aminophenyl)sulfonylamino]phenyl]-3-(2-phenylbutanoylamino)propanoate CAS Name: 3-[3-[(3-aminophenyl)sulfonylamino]phenyl]-3-[(1-oxo-2-phenylbutyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-[(3-aminophenyl)sulfonylamino]phenyl]-3-(2-phenylbutanoylamino)propanoate Traditional Name: 3-[3-[(3-aminophenyl)sulfonylamino]phenyl]-3-(2-phenylbutanoylamino)propionic acid ethyl ester Formula: C27H31N3O5S MolecularWeight: 509.61714

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC(CC(=O)OCC)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)N

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC(CC(=O)OCC)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)N

InChI

InChI=1S/C27H31N3O5S/c1-3-24(19-10-6-5-7-11-19)27(32)29-25(18-26(31)35-4-2)20-12-8-14-22(16-20)30-36(33,34)23-15-9-13-21(28)17-23/h5-17,24-25,30H,3-4,18,28H2,1-2H3,(H,29,32)