1-ethyl-N-[(2S,3R)-4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-4-(2-oxidanylidene-3H-pyrrol-1-yl)indole-6-carboxamide

Systemtic Name: 1-ethyl-N-[(2S,3R)-4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-4-(2-oxidanylidene-3H-pyrrol-1-yl)indole-6-carboxamide Openeye Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methylamino]propyl]-1-ethyl-4-(2-oxo-3H-pyrrol-1-yl)indole-6-carboxamide CAS Name: 1-ethyl-N-[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-4-(2-oxo-3H-pyrrol-1-yl)-6-indolecarboxamide IUPAC Name: 1-ethyl-N-[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-4-(2-oxo-3H-pyrrol-1-yl)indole-6-carboxamide Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-(m-anisylamino)propyl]-1-ethyl-4-(2-keto-2-pyrrolin-1-yl)indole-6-carboxamide Formula: C33H36N4O4 MolecularWeight: 552.66334

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC2=C1C=C(C=C2N3C=CCC3=O)C(=O)NC(CC4=CC=CC=C4)C(CNCC5=CC(=CC=C5)OC)O

Isomeric SMILES

CCN1C=CC2=C1C=C(C=C2N3C=CCC3=O)C(=O)N[C@@H](CC4=CC=CC=C4)[C@@H](CNCC5=CC(=CC=C5)OC)O

InChI

InChI=1S/C33H36N4O4/c1-3-36-16-14-27-29(36)19-25(20-30(27)37-15-8-13-32(37)39)33(40)35-28(18-23-9-5-4-6-10-23)31(38)22-34-21-24-11-7-12-26(17-24)41-2/h4-12,14-17,19-20,28,31,34,38H,3,13,18,21-22H2,1-2H3,(H,35,40)/t28-,31+/m0/s1