N-[6-(3-methylpentan-3-yl)pyridazin-3-yl]-2,6-dipropoxy-benzenecarbothioamide

Systemtic Name: N-[6-(3-methylpentan-3-yl)pyridazin-3-yl]-2,6-dipropoxy-benzenecarbothioamide Openeye Name: N-[6-(1-ethyl-1-methyl-propyl)pyridazin-3-yl]-2,6-dipropoxy-benzenecarbothioamide CAS Name: N-[6-(3-methylpentan-3-yl)-3-pyridazinyl]-2,6-dipropoxybenzenecarbothioamide IUPAC Name: N-[6-(3-methylpentan-3-yl)pyridazin-3-yl]-2,6-dipropoxybenzenecarbothioamide Traditional Name: N-[6-(1-ethyl-1-methyl-propyl)pyridazin-3-yl]-2,6-dipropoxy-thiobenzamide Formula: C23H33N3O2S MolecularWeight: 415.59202

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C(=CC=C1)OCCC)C(=S)NC2=NN=C(C=C2)C(C)(CC)CC

Isomeric SMILES

CCCOC1=C(C(=CC=C1)OCCC)C(=S)NC2=NN=C(C=C2)C(C)(CC)CC

InChI

InChI=1S/C23H33N3O2S/c1-6-15-27-17-11-10-12-18(28-16-7-2)21(17)22(29)24-20-14-13-19(25-26-20)23(5,8-3)9-4/h10-14H,6-9,15-16H2,1-5H3,(H,24,26,29)