N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[(4S)-chroman-4-yl]-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[(4S)-chroman-4-yl]-1,3-diphenyl-pyrazole-4-carboxamide Formula: C25H21N3O2 MolecularWeight: 395.45314

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1COC2=CC=CC=C2[C@H]1NC(=O)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H21N3O2/c29-25(26-22-15-16-30-23-14-8-7-13-20(22)23)21-17-28(19-11-5-2-6-12-19)27-24(21)18-9-3-1-4-10-18/h1-14,17,22H,15-16H2,(H,26,29)/t22-/m0/s1