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

Systemtic Name: 2-[(4-methoxyphenyl)methoxymethyl]-4-(3-nitrophenyl)sulfanyl-5-propan-2-yl-1H-imidazole Openeye Name: 5-isopropyl-2-[(4-methoxyphenyl)methoxymethyl]-4-(3-nitrophenyl)sulfanyl-1H-imidazole CAS Name: 2-[(4-methoxyphenyl)methoxymethyl]-4-[(3-nitrophenyl)thio]-5-propan-2-yl-1H-imidazole IUPAC Name: 2-[(4-methoxyphenyl)methoxymethyl]-4-(3-nitrophenyl)sulfanyl-5-propan-2-yl-1H-imidazole Traditional Name: 5-isopropyl-4-[(3-nitrophenyl)thio]-2-(p-anisyloxymethyl)-1H-imidazole Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4S/c1-14(2)20-21(29-18-6-4-5-16(11-18)24(25)26)23-19(22-20)13-28-12-15-7-9-17(27-3)10-8-15/h4-11,14H,12-13H2,1-3H3,(H,22,23)