2,6-dimethoxy-N-(5-nonan-3-yl-1,3,4-thiadiazol-2-yl)benzenecarbothioamide

Systemtic Name: 2,6-dimethoxy-N-(5-nonan-3-yl-1,3,4-thiadiazol-2-yl)benzenecarbothioamide Openeye Name: N-[5-(1-ethylheptyl)-1,3,4-thiadiazol-2-yl]-2,6-dimethoxy-benzenecarbothioamide CAS Name: 2,6-dimethoxy-N-(5-nonan-3-yl-1,3,4-thiadiazol-2-yl)benzenecarbothioamide IUPAC Name: 2,6-dimethoxy-N-(5-nonan-3-yl-1,3,4-thiadiazol-2-yl)benzenecarbothioamide Traditional Name: N-[5-(1-ethylheptyl)-1,3,4-thiadiazol-2-yl]-2,6-dimethoxy-thiobenzamide Formula: C20H29N3O2S2 MolecularWeight: 407.59316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC)C1=NN=C(S1)NC(=S)C2=C(C=CC=C2OC)OC

Isomeric SMILES

CCCCCCC(CC)C1=NN=C(S1)NC(=S)C2=C(C=CC=C2OC)OC

InChI

InChI=1S/C20H29N3O2S2/c1-5-7-8-9-11-14(6-2)19-22-23-20(27-19)21-18(26)17-15(24-3)12-10-13-16(17)25-4/h10,12-14H,5-9,11H2,1-4H3,(H,21,23,26)