2-(7-methoxy-1,3-benzodioxol-5-yl)-4-phenoxathiin-2-yl-5-phenyl-1H-imidazole

Systemtic Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-4-phenoxathiin-2-yl-5-phenyl-1H-imidazole Openeye Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-4-phenoxathiin-2-yl-5-phenyl-1H-imidazole CAS Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-4-(2-phenoxathiinyl)-5-phenyl-1H-imidazole IUPAC Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-4-phenoxathiin-2-yl-5-phenyl-1H-imidazole Traditional Name: 2-(7-methoxy-1,3-benzodioxol-5-yl)-4-phenoxathiin-2-yl-5-phenyl-1H-imidazole Formula: C29H20N2O4S MolecularWeight: 492.5451

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C3=NC(=C(N3)C4=CC=CC=C4)C5=CC6=C(C=C5)OC7=CC=CC=C7S6

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)C3=NC(=C(N3)C4=CC=CC=C4)C5=CC6=C(C=C5)OC7=CC=CC=C7S6

InChI

InChI=1S/C29H20N2O4S/c1-32-22-13-19(14-23-28(22)34-16-33-23)29-30-26(17-7-3-2-4-8-17)27(31-29)18-11-12-21-25(15-18)36-24-10-6-5-9-20(24)35-21/h2-15H,16H2,1H3,(H,30,31)