[2-oxidanyl-3-[2-oxidanylidene-2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]ethyl]sulfanyl-propyl] 2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]ethanoate

Systemtic Name: [2-oxidanyl-3-[2-oxidanylidene-2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]ethyl]sulfanyl-propyl] 2-[1-(4-chlorophenyl)carbonyl-5-methoxy-2-methyl-indol-3-yl]ethanoate Openeye Name: [2-hydroxy-3-[2-oxo-2-[3-[3-(1-piperidylmethyl)phenoxy]propylamino]ethyl]sulfanyl-propyl] 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]acetate CAS Name: 2-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]acetic acid [2-hydroxy-3-[[2-oxo-2-[3-[3-(1-piperidinylmethyl)phenoxy]propylamino]ethyl]thio]propyl] ester IUPAC Name: [2-hydroxy-3-[2-oxo-2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]ethyl]sulfanylpropyl] 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetate Traditional Name: 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]acetic acid [2-hydroxy-3-[[2-keto-2-[3-[3-(piperidinomethyl)phenoxy]propylamino]ethyl]thio]propyl] ester Formula: C39H46ClN3O7S MolecularWeight: 736.31644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OCC(CSCC(=O)NCCCOC4=CC=CC(=C4)CN5CCCCC5)O

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OCC(CSCC(=O)NCCCOC4=CC=CC(=C4)CN5CCCCC5)O

InChI

InChI=1S/C39H46ClN3O7S/c1-27-34(35-21-32(48-2)14-15-36(35)43(27)39(47)29-10-12-30(40)13-11-29)22-38(46)50-24-31(44)25-51-26-37(45)41-16-7-19-49-33-9-6-8-28(20-33)23-42-17-4-3-5-18-42/h6,8-15,20-21,31,44H,3-5,7,16-19,22-26H2,1-2H3,(H,41,45)