N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-N-[2-(propan-2-ylamino)pyrimidin-4-yl]-2,3-dihydro-1-benzofuran-5-carboxamide

Systemtic Name: N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-N-[2-(propan-2-ylamino)pyrimidin-4-yl]-2,3-dihydro-1-benzofuran-5-carboxamide Openeye Name: N-[2-(isopropylamino)pyrimidin-4-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2,3-dihydrobenzofuran-5-carboxamide CAS Name: N-[3-(2-oxo-1-pyrrolidinyl)propyl]-N-[2-(propan-2-ylamino)-4-pyrimidinyl]-2,3-dihydrobenzofuran-5-carboxamide IUPAC Name: N-[3-(2-oxopyrrolidin-1-yl)propyl]-N-[2-(propan-2-ylamino)pyrimidin-4-yl]-2,3-dihydro-1-benzofuran-5-carboxamide Traditional Name: N-[2-(isopropylamino)pyrimidin-4-yl]-N-[3-(2-ketopyrrolidino)propyl]coumaran-5-carboxamide Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=CC(=N1)N(CCCN2CCCC2=O)C(=O)C3=CC4=C(C=C3)OCC4

Isomeric SMILES

CC(C)NC1=NC=CC(=N1)N(CCCN2CCCC2=O)C(=O)C3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C23H29N5O3/c1-16(2)25-23-24-10-8-20(26-23)28(13-4-12-27-11-3-5-21(27)29)22(30)18-6-7-19-17(15-18)9-14-31-19/h6-8,10,15-16H,3-5,9,11-14H2,1-2H3,(H,24,25,26)