1-ethyl-N3-[(2S,3R)-4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-N5,N5-dipropyl-pyrazole-3,5-dicarboxamide

Systemtic Name: 1-ethyl-N3-[(2S,3R)-4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-N5,N5-dipropyl-pyrazole-3,5-dicarboxamide Openeye Name: N3-[(1S,2R)-1-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methylamino]propyl]-1-ethyl-N5,N5-dipropyl-pyrazole-3,5-dicarboxamide CAS Name: 1-ethyl-N3-[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-N5,N5-dipropylpyrazole-3,5-dicarboxamide IUPAC Name: 1-ethyl-3-N-[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-5-N,5-N-dipropylpyrazole-3,5-dicarboxamide Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-(m-anisylamino)propyl]-1-ethyl-N',N'-dipropyl-pyrazole-3,5-dicarboxamide Formula: C31H43N5O4 MolecularWeight: 549.70422

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=NN1CC)C(=O)NC(CC2=CC=CC=C2)C(CNCC3=CC(=CC=C3)OC)O

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=NN1CC)C(=O)N[C@@H](CC2=CC=CC=C2)[C@@H](CNCC3=CC(=CC=C3)OC)O

InChI

InChI=1S/C31H43N5O4/c1-5-16-35(17-6-2)31(39)28-20-27(34-36(28)7-3)30(38)33-26(19-23-12-9-8-10-13-23)29(37)22-32-21-24-14-11-15-25(18-24)40-4/h8-15,18,20,26,29,32,37H,5-7,16-17,19,21-22H2,1-4H3,(H,33,38)/t26-,29+/m0/s1