7-(5-phenyl-4-pyridin-4-yl-1H-pyrrol-2-yl)-2,3-dihydro-1,4$l^{4}-benzoxathiine 4-oxide

Systemtic Name: 7-(5-phenyl-4-pyridin-4-yl-1H-pyrrol-2-yl)-2,3-dihydro-1,4$l^{4}-benzoxathiine 4-oxide Openeye Name: 7-[5-phenyl-4-(4-pyridyl)-1H-pyrrol-2-yl]-2,3-dihydro-1,4$l^{4}-benzoxathiine 4-oxide CAS Name: 7-(5-phenyl-4-pyridin-4-yl-1H-pyrrol-2-yl)-2,3-dihydro-1,4$l^{4}-benzoxathiin 4-oxide IUPAC Name: 7-(5-phenyl-4-pyridin-4-yl-1H-pyrrol-2-yl)-2,3-dihydro-1,4$l^{4}-benzoxathiine 4-oxide Traditional Name: 7-[5-phenyl-4-(4-pyridyl)-1H-pyrrol-2-yl]-2,3-dihydro-1,4$l^{4}-benzoxathiin 4-oxide Formula: C23H18N2O2S MolecularWeight: 386.46622

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)C2=C(O1)C=C(C=C2)C3=CC(=C(N3)C4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

C1CS(=O)C2=C(O1)C=C(C=C2)C3=CC(=C(N3)C4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C23H18N2O2S/c26-28-13-12-27-21-14-18(6-7-22(21)28)20-15-19(16-8-10-24-11-9-16)23(25-20)17-4-2-1-3-5-17/h1-11,14-15,25H,12-13H2