diethyl-[2-[6-[2-(3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazin-3-yl]sulfanylethyl]azanium

Systemtic Name: diethyl-[2-[6-[2-(3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazin-3-yl]sulfanylethyl]azanium Openeye Name: diethyl-[2-[6-[2-(3-methoxyphenyl)-4-methyl-thiazol-5-yl]pyridazin-3-yl]sulfanylethyl]ammonium CAS Name: diethyl-[2-[[6-[2-(3-methoxyphenyl)-4-methyl-5-thiazolyl]-3-pyridazinyl]thio]ethyl]ammonium IUPAC Name: diethyl-[2-[6-[2-(3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]pyridazin-3-yl]sulfanylethyl]azanium Traditional Name: diethyl-[2-[[6-[2-(3-methoxyphenyl)-4-methyl-thiazol-5-yl]pyridazin-3-yl]thio]ethyl]ammonium Formula: C21H27N4OS2+ MolecularWeight: 415.59528

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCSC1=NN=C(C=C1)C2=C(N=C(S2)C3=CC(=CC=C3)OC)C

Isomeric SMILES

CC[NH+](CC)CCSC1=NN=C(C=C1)C2=C(N=C(S2)C3=CC(=CC=C3)OC)C

InChI

InChI=1S/C21H26N4OS2/c1-5-25(6-2)12-13-27-19-11-10-18(23-24-19)20-15(3)22-21(28-20)16-8-7-9-17(14-16)26-4/h7-11,14H,5-6,12-13H2,1-4H3/p+1