2-(3-methoxyphenyl)-4-methyl-5-[6-[(3-nitrophenyl)methylsulfanyl]pyridazin-3-yl]-1,3-thiazole

Systemtic Name: 2-(3-methoxyphenyl)-4-methyl-5-[6-[(3-nitrophenyl)methylsulfanyl]pyridazin-3-yl]-1,3-thiazole Openeye Name: 2-(3-methoxyphenyl)-4-methyl-5-[6-[(3-nitrophenyl)methylsulfanyl]pyridazin-3-yl]thiazole CAS Name: 2-(3-methoxyphenyl)-4-methyl-5-[6-[(3-nitrophenyl)methylthio]-3-pyridazinyl]thiazole IUPAC Name: 2-(3-methoxyphenyl)-4-methyl-5-[6-[(3-nitrophenyl)methylsulfanyl]pyridazin-3-yl]-1,3-thiazole Traditional Name: 2-(3-methoxyphenyl)-4-methyl-5-[6-[(3-nitrobenzyl)thio]pyridazin-3-yl]thiazole Formula: C22H18N4O3S2 MolecularWeight: 450.53332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC(=CC=C2)OC)C3=NN=C(C=C3)SCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)C2=CC(=CC=C2)OC)C3=NN=C(C=C3)SCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O3S2/c1-14-21(31-22(23-14)16-6-4-8-18(12-16)29-2)19-9-10-20(25-24-19)30-13-15-5-3-7-17(11-15)26(27)28/h3-12H,13H2,1-2H3