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

Systemtic Name: 2-(chloromethyl)-5-(3-nitrophenyl)sulfanyl-1-(phenylmethyl)-4-propan-2-yl-imidazole Openeye Name: 1-benzyl-2-(chloromethyl)-4-isopropyl-5-(3-nitrophenyl)sulfanyl-imidazole CAS Name: 2-(chloromethyl)-5-[(3-nitrophenyl)thio]-1-(phenylmethyl)-4-propan-2-ylimidazole IUPAC Name: 1-benzyl-2-(chloromethyl)-5-(3-nitrophenyl)sulfanyl-4-propan-2-ylimidazole Traditional Name: 1-benzyl-2-(chloromethyl)-4-isopropyl-5-[(3-nitrophenyl)thio]imidazole Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)CCl)CC2=CC=CC=C2)SC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(N(C(=N1)CCl)CC2=CC=CC=C2)SC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN3O2S/c1-14(2)19-20(27-17-10-6-9-16(11-17)24(25)26)23(18(12-21)22-19)13-15-7-4-3-5-8-15/h3-11,14H,12-13H2,1-2H3