5-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanylmethyl]-3-(3-nitrophenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanylmethyl]-3-(3-nitrophenyl)-1,2,4-oxadiazole Openeye Name: 5-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanylmethyl]-3-(3-nitrophenyl)-1,2,4-oxadiazole CAS Name: 5-[[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]methyl]-3-(3-nitrophenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanylmethyl]-3-(3-nitrophenyl)-1,2,4-oxadiazole Traditional Name: 5-[[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]methyl]-3-(3-nitrophenyl)-1,2,4-oxadiazole Formula: C20H17N5O3S MolecularWeight: 407.44568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC2=NC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(N1)SCC2=NC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C20H17N5O3S/c1-13-17(10-14-6-3-2-4-7-14)22-20(21-13)29-12-18-23-19(24-28-18)15-8-5-9-16(11-15)25(26)27/h2-9,11H,10,12H2,1H3,(H,21,22)