[2-[[6-acetyloxy-1-methyl-3-(phenylcarbamoyl)indol-2-yl]disulfanyl]-1-methyl-3-(phenylcarbamoyl)indol-6-yl] ethanoate

Systemtic Name: [2-[[6-acetyloxy-1-methyl-3-(phenylcarbamoyl)indol-2-yl]disulfanyl]-1-methyl-3-(phenylcarbamoyl)indol-6-yl] ethanoate Openeye Name: [2-[[6-acetoxy-1-methyl-3-(phenylcarbamoyl)indol-2-yl]disulfanyl]-1-methyl-3-(phenylcarbamoyl)indol-6-yl] acetate CAS Name: acetic acid [2-[[6-acetyloxy-3-[anilino(oxo)methyl]-1-methyl-2-indolyl]disulfanyl]-3-[anilino(oxo)methyl]-1-methyl-6-indolyl] ester IUPAC Name: [2-[[6-acetyloxy-1-methyl-3-(phenylcarbamoyl)indol-2-yl]disulfanyl]-1-methyl-3-(phenylcarbamoyl)indol-6-yl] acetate Traditional Name: acetic acid [2-[[6-acetoxy-1-methyl-3-(phenylcarbamoyl)indol-2-yl]disulfanyl]-1-methyl-3-(phenylcarbamoyl)indol-6-yl] ester Formula: C36H30N4O6S2 MolecularWeight: 678.7766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1)C(=C(N2C)SSC3=C(C4=C(N3C)C=C(C=C4)OC(=O)C)C(=O)NC5=CC=CC=C5)C(=O)NC6=CC=CC=C6

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1)C(=C(N2C)SSC3=C(C4=C(N3C)C=C(C=C4)OC(=O)C)C(=O)NC5=CC=CC=C5)C(=O)NC6=CC=CC=C6

InChI

InChI=1S/C36H30N4O6S2/c1-21(41)45-25-15-17-27-29(19-25)39(3)35(31(27)33(43)37-23-11-7-5-8-12-23)47-48-36-32(34(44)38-24-13-9-6-10-14-24)28-18-16-26(46-22(2)42)20-30(28)40(36)4/h5-20H,1-4H3,(H,37,43)(H,38,44)