2-[(4-methoxyphenyl)methoxymethyl]-1-methyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-imidazole

Systemtic Name: 2-[(4-methoxyphenyl)methoxymethyl]-1-methyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-imidazole Openeye Name: 4-isopropyl-2-[(4-methoxyphenyl)methoxymethyl]-1-methyl-5-(3-nitrophenyl)sulfanyl-imidazole CAS Name: 2-[(4-methoxyphenyl)methoxymethyl]-1-methyl-5-[(3-nitrophenyl)thio]-4-propan-2-ylimidazole IUPAC Name: 2-[(4-methoxyphenyl)methoxymethyl]-1-methyl-5-(3-nitrophenyl)sulfanyl-4-propan-2-ylimidazole Traditional Name: 4-isopropyl-1-methyl-5-[(3-nitrophenyl)thio]-2-(p-anisyloxymethyl)imidazole Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)COCC2=CC=C(C=C2)OC)C)SC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(N(C(=N1)COCC2=CC=C(C=C2)OC)C)SC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O4S/c1-15(2)21-22(30-19-7-5-6-17(12-19)25(26)27)24(3)20(23-21)14-29-13-16-8-10-18(28-4)11-9-16/h5-12,15H,13-14H2,1-4H3