N-[4-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-2-yl]-4-(pyrazol-1-ylmethyl)benzamide

Systemtic Name: N-[4-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-2-yl]-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-[4-(2,3-dihydrobenzofuran-5-yl)thiazol-2-yl]-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[4-(2,3-dihydrobenzofuran-5-yl)-2-thiazolyl]-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-[4-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-2-yl]-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-(4-coumaran-5-ylthiazol-2-yl)-4-(pyrazol-1-ylmethyl)benzamide Formula: C22H18N4O2S MolecularWeight: 402.46892

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC=C(C=C4)CN5C=CC=N5

Isomeric SMILES

C1COC2=C1C=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC=C(C=C4)CN5C=CC=N5

InChI

InChI=1S/C22H18N4O2S/c27-21(16-4-2-15(3-5-16)13-26-10-1-9-23-26)25-22-24-19(14-29-22)17-6-7-20-18(12-17)8-11-28-20/h1-7,9-10,12,14H,8,11,13H2,(H,24,25,27)