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

Systemtic Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(2-methoxyphenyl)-1-phenyl-N-[(4S)-thiochroman-4-yl]pyrazole-4-carboxamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-3-(2-methoxyphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-(2-methoxyphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(2-methoxyphenyl)-1-phenyl-N-[(4S)-thiochroman-4-yl]pyrazole-4-carboxamide Formula: C26H23N3O2S MolecularWeight: 441.54472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN(C=C2C(=O)NC3CCSC4=CC=CC=C34)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1C2=NN(C=C2C(=O)N[C@H]3CCSC4=CC=CC=C34)C5=CC=CC=C5

InChI

InChI=1S/C26H23N3O2S/c1-31-23-13-7-5-12-20(23)25-21(17-29(28-25)18-9-3-2-4-10-18)26(30)27-22-15-16-32-24-14-8-6-11-19(22)24/h2-14,17,22H,15-16H2,1H3,(H,27,30)/t22-/m0/s1