2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole

Systemtic Name: 2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole Openeye Name: 2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-thiazole CAS Name: 2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-5-nitrothiazole IUPAC Name: 2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole Traditional Name: 2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-5-nitro-thiazole Formula: C18H13N5O3S2 MolecularWeight: 411.45752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2C3=CC=CC=C3)SC4=NC=C(S4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2C3=CC=CC=C3)SC4=NC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C18H13N5O3S2/c1-26-14-10-6-5-9-13(14)16-20-21-17(22(16)12-7-3-2-4-8-12)28-18-19-11-15(27-18)23(24)25/h2-11H,1H3