methyl 5-(4-fluorophenyl)-2-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-4-pyridin-4-yl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-(4-fluorophenyl)-2-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-4-pyridin-4-yl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-(4-fluorophenyl)-2-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-4-(4-pyridyl)-1H-pyrrole-3-carboxylate CAS Name: 5-(4-fluorophenyl)-2-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-4-pyridin-4-yl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-fluorophenyl)-2-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-4-pyridin-4-yl-1H-pyrrole-3-carboxylate Traditional Name: 5-(4-fluorophenyl)-2-(4-methyl-2,3-dihydro-1,4-benzothiazin-6-yl)-4-(4-pyridyl)-1H-pyrrole-3-carboxylic acid methyl ester Formula: C26H22FN3O2S MolecularWeight: 459.535183

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCSC2=C1C=C(C=C2)C3=C(C(=C(N3)C4=CC=C(C=C4)F)C5=CC=NC=C5)C(=O)OC

Isomeric SMILES

CN1CCSC2=C1C=C(C=C2)C3=C(C(=C(N3)C4=CC=C(C=C4)F)C5=CC=NC=C5)C(=O)OC

InChI

InChI=1S/C26H22FN3O2S/c1-30-13-14-33-21-8-5-18(15-20(21)30)25-23(26(31)32-2)22(16-9-11-28-12-10-16)24(29-25)17-3-6-19(27)7-4-17/h3-12,15,29H,13-14H2,1-2H3