5-(3-nitrophenyl)sulfanyl-2-(phenylmethoxymethyl)-1-(phenylmethyl)-4-propan-2-yl-imidazole

Systemtic Name: 5-(3-nitrophenyl)sulfanyl-2-(phenylmethoxymethyl)-1-(phenylmethyl)-4-propan-2-yl-imidazole Openeye Name: 1-benzyl-2-(benzyloxymethyl)-4-isopropyl-5-(3-nitrophenyl)sulfanyl-imidazole CAS Name: 5-[(3-nitrophenyl)thio]-2-(phenylmethoxymethyl)-1-(phenylmethyl)-4-propan-2-ylimidazole IUPAC Name: 1-benzyl-5-(3-nitrophenyl)sulfanyl-2-(phenylmethoxymethyl)-4-propan-2-ylimidazole Traditional Name: 2-(benzoxymethyl)-1-benzyl-4-isopropyl-5-[(3-nitrophenyl)thio]imidazole Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)COCC2=CC=CC=C2)CC3=CC=CC=C3)SC4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(N(C(=N1)COCC2=CC=CC=C2)CC3=CC=CC=C3)SC4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H27N3O3S/c1-20(2)26-27(34-24-15-9-14-23(16-24)30(31)32)29(17-21-10-5-3-6-11-21)25(28-26)19-33-18-22-12-7-4-8-13-22/h3-16,20H,17-19H2,1-2H3