ethyl 2-[3-[4-[butyl(butylcarbamoyl)amino]phenyl]sulfanylphenyl]ethanoate

Systemtic Name: ethyl 2-[3-[4-[butyl(butylcarbamoyl)amino]phenyl]sulfanylphenyl]ethanoate Openeye Name: ethyl 2-[3-[4-[butyl(butylcarbamoyl)amino]phenyl]sulfanylphenyl]acetate CAS Name: 2-[3-[[4-[butyl-[butylamino(oxo)methyl]amino]phenyl]thio]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[4-[butyl(butylcarbamoyl)amino]phenyl]sulfanylphenyl]acetate Traditional Name: 2-[3-[[4-[butyl(butylcarbamoyl)amino]phenyl]thio]phenyl]acetic acid ethyl ester Formula: C25H34N2O3S MolecularWeight: 442.61406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(CCCC)C1=CC=C(C=C1)SC2=CC=CC(=C2)CC(=O)OCC

Isomeric SMILES

CCCCNC(=O)N(CCCC)C1=CC=C(C=C1)SC2=CC=CC(=C2)CC(=O)OCC

InChI

InChI=1S/C25H34N2O3S/c1-4-7-16-26-25(29)27(17-8-5-2)21-12-14-22(15-13-21)31-23-11-9-10-20(18-23)19-24(28)30-6-3/h9-15,18H,4-8,16-17,19H2,1-3H3,(H,26,29)