[3-[3-[butylcarbamoyl(3-phenylpropyl)amino]phenyl]sulfanylphenyl] ethanoate

Systemtic Name: [3-[3-[butylcarbamoyl(3-phenylpropyl)amino]phenyl]sulfanylphenyl] ethanoate Openeye Name: [3-[3-[butylcarbamoyl(3-phenylpropyl)amino]phenyl]sulfanylphenyl] acetate CAS Name: acetic acid [3-[[3-[[butylamino(oxo)methyl]-(3-phenylpropyl)amino]phenyl]thio]phenyl] ester IUPAC Name: [3-[3-[butylcarbamoyl(3-phenylpropyl)amino]phenyl]sulfanylphenyl] acetate Traditional Name: acetic acid [3-[[3-[butylcarbamoyl(3-phenylpropyl)amino]phenyl]thio]phenyl] ester Formula: C28H32N2O3S MolecularWeight: 476.63028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(CCCC1=CC=CC=C1)C2=CC(=CC=C2)SC3=CC=CC(=C3)OC(=O)C

Isomeric SMILES

CCCCNC(=O)N(CCCC1=CC=CC=C1)C2=CC(=CC=C2)SC3=CC=CC(=C3)OC(=O)C

InChI

InChI=1S/C28H32N2O3S/c1-3-4-18-29-28(32)30(19-10-13-23-11-6-5-7-12-23)24-14-8-16-26(20-24)34-27-17-9-15-25(21-27)33-22(2)31/h5-9,11-12,14-17,20-21H,3-4,10,13,18-19H2,1-2H3,(H,29,32)