N-[[5-(2-methyl-2,3-dihydro-1-benzofuran-6-yl)-1,2-oxazol-3-yl]methyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide

Systemtic Name: N-[[5-(2-methyl-2,3-dihydro-1-benzofuran-6-yl)-1,2-oxazol-3-yl]methyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide Openeye Name: N-[[5-(2-methyl-2,3-dihydrobenzofuran-6-yl)isoxazol-3-yl]methyl]-5-(2-thienyl)-1H-pyrazole-3-carboxamide CAS Name: N-[[5-(2-methyl-2,3-dihydrobenzofuran-6-yl)-3-isoxazolyl]methyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide IUPAC Name: N-[[5-(2-methyl-2,3-dihydro-1-benzofuran-6-yl)-1,2-oxazol-3-yl]methyl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide Traditional Name: N-[[5-(2-methylcoumaran-6-yl)isoxazol-3-yl]methyl]-5-(2-thienyl)-1H-pyrazole-3-carboxamide Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=C(C=C2)C3=CC(=NO3)CNC(=O)C4=NNC(=C4)C5=CC=CS5

Isomeric SMILES

CC1CC2=C(O1)C=C(C=C2)C3=CC(=NO3)CNC(=O)C4=NNC(=C4)C5=CC=CS5

InChI

InChI=1S/C21H18N4O3S/c1-12-7-13-4-5-14(8-18(13)27-12)19-9-15(25-28-19)11-22-21(26)17-10-16(23-24-17)20-3-2-6-29-20/h2-6,8-10,12H,7,11H2,1H3,(H,22,26)(H,23,24)