N-[(1-methylpyrazol-4-yl)methyl]-2-phenethyl-1,3-benzoxazole-5-carboxamide

Systemtic Name: N-[(1-methylpyrazol-4-yl)methyl]-2-phenethyl-1,3-benzoxazole-5-carboxamide Openeye Name: N-[(1-methylpyrazol-4-yl)methyl]-2-phenethyl-1,3-benzoxazole-5-carboxamide CAS Name: N-[(1-methyl-4-pyrazolyl)methyl]-2-phenethyl-1,3-benzoxazole-5-carboxamide IUPAC Name: N-[(1-methylpyrazol-4-yl)methyl]-2-phenethyl-1,3-benzoxazole-5-carboxamide Traditional Name: N-[(1-methylpyrazol-4-yl)methyl]-2-phenethyl-1,3-benzoxazole-5-carboxamide Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC(=O)C2=CC3=C(C=C2)OC(=N3)CCC4=CC=CC=C4

Isomeric SMILES

CN1C=C(C=N1)CNC(=O)C2=CC3=C(C=C2)OC(=N3)CCC4=CC=CC=C4

InChI

InChI=1S/C21H20N4O2/c1-25-14-16(13-23-25)12-22-21(26)17-8-9-19-18(11-17)24-20(27-19)10-7-15-5-3-2-4-6-15/h2-6,8-9,11,13-14H,7,10,12H2,1H3,(H,22,26)