(2S)-2-(2,3-dihydro-1-benzofuran-6-ylmethylamino)-N-(5-phenyl-1H-pyrazol-3-yl)pentanamide

Systemtic Name: (2S)-2-(2,3-dihydro-1-benzofuran-6-ylmethylamino)-N-(5-phenyl-1H-pyrazol-3-yl)pentanamide Openeye Name: (2S)-2-(2,3-dihydrobenzofuran-6-ylmethylamino)-N-(5-phenyl-1H-pyrazol-3-yl)pentanamide CAS Name: (2S)-2-(2,3-dihydrobenzofuran-6-ylmethylamino)-N-(5-phenyl-1H-pyrazol-3-yl)pentanamide IUPAC Name: (2S)-2-(2,3-dihydro-1-benzofuran-6-ylmethylamino)-N-(5-phenyl-1H-pyrazol-3-yl)pentanamide Traditional Name: (2S)-2-(coumaran-6-ylmethylamino)-N-(5-phenyl-1H-pyrazol-3-yl)valeramide Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=NNC(=C1)C2=CC=CC=C2)NCC3=CC4=C(CCO4)C=C3

Isomeric SMILES

CCC[C@@H](C(=O)NC1=NNC(=C1)C2=CC=CC=C2)NCC3=CC4=C(CCO4)C=C3

InChI

InChI=1S/C23H26N4O2/c1-2-6-19(24-15-16-9-10-18-11-12-29-21(18)13-16)23(28)25-22-14-20(26-27-22)17-7-4-3-5-8-17/h3-5,7-10,13-14,19,24H,2,6,11-12,15H2,1H3,(H2,25,26,27,28)/t19-/m0/s1