N-[(7-chloranyl-5-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]-4-phenyl-butanamide

Systemtic Name: N-[(7-chloranyl-5-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]-4-phenyl-butanamide Openeye Name: N-[(7-chloro-5-pyrimidin-5-yl-2,3-dihydrobenzofuran-2-yl)methyl]-4-phenyl-butanamide CAS Name: N-[[7-chloro-5-(5-pyrimidinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4-phenylbutanamide IUPAC Name: N-[(7-chloro-5-pyrimidin-5-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]-4-phenylbutanamide Traditional Name: N-[[7-chloro-5-(5-pyrimidyl)coumaran-2-yl]methyl]-4-phenyl-butyramide Formula: C23H22ClN3O2 MolecularWeight: 407.89268

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2Cl)C3=CN=CN=C3)CNC(=O)CCCC4=CC=CC=C4

Isomeric SMILES

C1C(OC2=C1C=C(C=C2Cl)C3=CN=CN=C3)CNC(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C23H22ClN3O2/c24-21-11-17(19-12-25-15-26-13-19)9-18-10-20(29-23(18)21)14-27-22(28)8-4-7-16-5-2-1-3-6-16/h1-3,5-6,9,11-13,15,20H,4,7-8,10,14H2,(H,27,28)