N-[[(2R)-7-(1,3-benzothiazol-2-yl)-5-methyl-2,3-dihydro-1-benzofuran-2-yl]methyl]-1,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[[(2R)-7-(1,3-benzothiazol-2-yl)-5-methyl-2,3-dihydro-1-benzofuran-2-yl]methyl]-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[[(2R)-7-(1,3-benzothiazol-2-yl)-5-methyl-2,3-dihydrobenzofuran-2-yl]methyl]-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[[(2R)-7-(1,3-benzothiazol-2-yl)-5-methyl-2,3-dihydrobenzofuran-2-yl]methyl]-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[[(2R)-7-(1,3-benzothiazol-2-yl)-5-methyl-2,3-dihydro-1-benzofuran-2-yl]methyl]-1,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[[(2R)-7-(1,3-benzothiazol-2-yl)-5-methyl-coumaran-2-yl]methyl]-1,5-dimethyl-pyrazole-3-carboxamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)C3=NC4=CC=CC=C4S3)OC(C2)CNC(=O)C5=NN(C(=C5)C)C

Isomeric SMILES

CC1=CC2=C(C(=C1)C3=NC4=CC=CC=C4S3)O[C@H](C2)CNC(=O)C5=NN(C(=C5)C)C

InChI

InChI=1S/C23H22N4O2S/c1-13-8-15-11-16(12-24-22(28)19-10-14(2)27(3)26-19)29-21(15)17(9-13)23-25-18-6-4-5-7-20(18)30-23/h4-10,16H,11-12H2,1-3H3,(H,24,28)/t16-/m1/s1