4-(2-tert-butyl-5-phenoxathiin-4-yl-1H-imidazol-4-yl)pyridine

Systemtic Name: 4-(2-tert-butyl-5-phenoxathiin-4-yl-1H-imidazol-4-yl)pyridine Openeye Name: 4-(2-tert-butyl-5-phenoxathiin-4-yl-1H-imidazol-4-yl)pyridine CAS Name: 4-[2-tert-butyl-5-(4-phenoxathiinyl)-1H-imidazol-4-yl]pyridine IUPAC Name: 4-(2-tert-butyl-5-phenoxathiin-4-yl-1H-imidazol-4-yl)pyridine Traditional Name: 4-(2-tert-butyl-5-phenoxathiin-4-yl-1H-imidazol-4-yl)pyridine Formula: C24H21N3OS MolecularWeight: 399.50804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=C(N1)C2=C3C(=CC=C2)SC4=CC=CC=C4O3)C5=CC=NC=C5

Isomeric SMILES

CC(C)(C)C1=NC(=C(N1)C2=C3C(=CC=C2)SC4=CC=CC=C4O3)C5=CC=NC=C5

InChI

InChI=1S/C24H21N3OS/c1-24(2,3)23-26-20(15-11-13-25-14-12-15)21(27-23)16-7-6-10-19-22(16)28-17-8-4-5-9-18(17)29-19/h4-14H,1-3H3,(H,26,27)