1-butyl-2-[4-[[2-(imidazol-1-ylmethyl)-2-thiophen-2-yl-1,3-dioxolan-4-yl]methoxy]phenyl]-4-(phenylmethyl)imidazole

Systemtic Name: 1-butyl-2-[4-[[2-(imidazol-1-ylmethyl)-2-thiophen-2-yl-1,3-dioxolan-4-yl]methoxy]phenyl]-4-(phenylmethyl)imidazole Openeye Name: 4-benzyl-1-butyl-2-[4-[[2-(imidazol-1-ylmethyl)-2-(2-thienyl)-1,3-dioxolan-4-yl]methoxy]phenyl]imidazole CAS Name: 1-butyl-2-[4-[[2-(1-imidazolylmethyl)-2-thiophen-2-yl-1,3-dioxolan-4-yl]methoxy]phenyl]-4-(phenylmethyl)imidazole IUPAC Name: 4-benzyl-1-butyl-2-[4-[[2-(imidazol-1-ylmethyl)-2-thiophen-2-yl-1,3-dioxolan-4-yl]methoxy]phenyl]imidazole Traditional Name: 4-benzyl-1-butyl-2-[4-[[2-(imidazol-1-ylmethyl)-2-(2-thienyl)-1,3-dioxolan-4-yl]methoxy]phenyl]imidazole Formula: C32H34N4O3S MolecularWeight: 554.70236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(N=C1C2=CC=C(C=C2)OCC3COC(O3)(CN4C=CN=C4)C5=CC=CS5)CC6=CC=CC=C6

Isomeric SMILES

CCCCN1C=C(N=C1C2=CC=C(C=C2)OCC3COC(O3)(CN4C=CN=C4)C5=CC=CS5)CC6=CC=CC=C6

InChI

InChI=1S/C32H34N4O3S/c1-2-3-16-36-20-27(19-25-8-5-4-6-9-25)34-31(36)26-11-13-28(14-12-26)37-21-29-22-38-32(39-29,30-10-7-18-40-30)23-35-17-15-33-24-35/h4-15,17-18,20,24,29H,2-3,16,19,21-23H2,1H3