[3-[4-[heptyl(hexylcarbamoyl)amino]phenyl]sulfanylphenyl] ethanoate

Systemtic Name: [3-[4-[heptyl(hexylcarbamoyl)amino]phenyl]sulfanylphenyl] ethanoate Openeye Name: [3-[4-[heptyl(hexylcarbamoyl)amino]phenyl]sulfanylphenyl] acetate CAS Name: acetic acid [3-[[4-[heptyl-[(hexylamino)-oxomethyl]amino]phenyl]thio]phenyl] ester IUPAC Name: [3-[4-[heptyl(hexylcarbamoyl)amino]phenyl]sulfanylphenyl] acetate Traditional Name: acetic acid [3-[[4-[heptyl(hexylcarbamoyl)amino]phenyl]thio]phenyl] ester Formula: C28H40N2O3S MolecularWeight: 484.6938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(C1=CC=C(C=C1)SC2=CC=CC(=C2)OC(=O)C)C(=O)NCCCCCC

Isomeric SMILES

CCCCCCCN(C1=CC=C(C=C1)SC2=CC=CC(=C2)OC(=O)C)C(=O)NCCCCCC

InChI

InChI=1S/C28H40N2O3S/c1-4-6-8-10-12-21-30(28(32)29-20-11-9-7-5-2)24-16-18-26(19-17-24)34-27-15-13-14-25(22-27)33-23(3)31/h13-19,22H,4-12,20-21H2,1-3H3,(H,29,32)