N-[(3,4-dichlorophenyl)methyl]-5-[(2R)-2-[[(2R)-2-[3-(methylsulfonylamino)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]amino]propyl]-1H-indole-2-carboxamide

Systemtic Name: N-[(3,4-dichlorophenyl)methyl]-5-[(2R)-2-[[(2R)-2-[3-(methylsulfonylamino)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]amino]propyl]-1H-indole-2-carboxamide Openeye Name: N-[(3,4-dichlorophenyl)methyl]-5-[(2R)-2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]propyl]-1H-indole-2-carboxamide CAS Name: N-[(3,4-dichlorophenyl)methyl]-5-[(2R)-2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]propyl]-1H-indole-2-carboxamide IUPAC Name: N-[(3,4-dichlorophenyl)methyl]-5-[(2R)-2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]propyl]-1H-indole-2-carboxamide Traditional Name: N-(3,4-dichlorobenzyl)-5-[(2R)-2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]propyl]-1H-indole-2-carboxamide Formula: C28H30Cl2N4O5S MolecularWeight: 605.5326

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC2=C(C=C1)NC(=C2)C(=O)NCC3=CC(=C(C=C3)Cl)Cl)NCC(C4=CC(=C(C=C4)O)NS(=O)(=O)C)O

Isomeric SMILES

C[C@H](CC1=CC2=C(C=C1)NC(=C2)C(=O)NCC3=CC(=C(C=C3)Cl)Cl)NC[C@@H](C4=CC(=C(C=C4)O)NS(=O)(=O)C)O

InChI

InChI=1S/C28H30Cl2N4O5S/c1-16(31-15-27(36)19-5-8-26(35)24(12-19)34-40(2,38)39)9-17-4-7-23-20(10-17)13-25(33-23)28(37)32-14-18-3-6-21(29)22(30)11-18/h3-8,10-13,16,27,31,33-36H,9,14-15H2,1-2H3,(H,32,37)/t16-,27+/m1/s1