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

Systemtic Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[(4S)-chroman-4-yl]-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[(4S)-chroman-4-yl]-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)C3=CN(N=C3C4=CN=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1COC2=CC=CC=C2[C@H]1NC(=O)C3=CN(N=C3C4=CN=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C25H22N4O2/c30-25(27-22-12-14-31-23-11-5-4-10-20(22)23)21-17-29(16-18-7-2-1-3-8-18)28-24(21)19-9-6-13-26-15-19/h1-11,13,15,17,22H,12,14,16H2,(H,27,30)/t22-/m0/s1