6-[4-[[2-(imidazol-1-ylmethyl)-2-thiophen-2-yl-1,3-dioxolan-4-yl]methoxy]phenyl]-1H-pyrimidine-2-thione

Systemtic Name: 6-[4-[[2-(imidazol-1-ylmethyl)-2-thiophen-2-yl-1,3-dioxolan-4-yl]methoxy]phenyl]-1H-pyrimidine-2-thione Openeye Name: 6-[4-[[2-(imidazol-1-ylmethyl)-2-(2-thienyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-1H-pyrimidine-2-thione CAS Name: 6-[4-[[2-(1-imidazolylmethyl)-2-thiophen-2-yl-1,3-dioxolan-4-yl]methoxy]phenyl]-1H-pyrimidine-2-thione IUPAC Name: 6-[4-[[2-(imidazol-1-ylmethyl)-2-thiophen-2-yl-1,3-dioxolan-4-yl]methoxy]phenyl]-1H-pyrimidine-2-thione Traditional Name: 6-[4-[[2-(imidazol-1-ylmethyl)-2-(2-thienyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-1H-pyrimidine-2-thione Formula: C22H20N4O3S2 MolecularWeight: 452.5492

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(O1)(CN2C=CN=C2)C3=CC=CS3)COC4=CC=C(C=C4)C5=CC=NC(=S)N5

Isomeric SMILES

C1C(OC(O1)(CN2C=CN=C2)C3=CC=CS3)COC4=CC=C(C=C4)C5=CC=NC(=S)N5

InChI

InChI=1S/C22H20N4O3S2/c30-21-24-8-7-19(25-21)16-3-5-17(6-4-16)27-12-18-13-28-22(29-18,20-2-1-11-31-20)14-26-10-9-23-15-26/h1-11,15,18H,12-14H2,(H,24,25,30)