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

Systemtic Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxamide Openeye Name: N-[(4S)-chroman-4-yl]-1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-1-(4-fluorophenyl)-3-(3-methoxyphenyl)-4-pyrazolecarboxamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxamide Traditional Name: N-[(4S)-chroman-4-yl]-1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-4-carboxamide Formula: C26H22FN3O3 MolecularWeight: 443.469583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)NC3CCOC4=CC=CC=C34)C5=CC=C(C=C5)F

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)N[C@H]3CCOC4=CC=CC=C34)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H22FN3O3/c1-32-20-6-4-5-17(15-20)25-22(16-30(29-25)19-11-9-18(27)10-12-19)26(31)28-23-13-14-33-24-8-3-2-7-21(23)24/h2-12,15-16,23H,13-14H2,1H3,(H,28,31)/t23-/m0/s1