N-[3-(3-ethylnonan-3-yl)-1,2-oxazol-5-yl]-2,6-dimethoxy-benzenecarbothioamide

Systemtic Name: N-[3-(3-ethylnonan-3-yl)-1,2-oxazol-5-yl]-2,6-dimethoxy-benzenecarbothioamide Openeye Name: N-[3-(1,1-diethylheptyl)isoxazol-5-yl]-2,6-dimethoxy-benzenecarbothioamide CAS Name: N-[3-(3-ethylnonan-3-yl)-5-isoxazolyl]-2,6-dimethoxybenzenecarbothioamide IUPAC Name: N-[3-(3-ethylnonan-3-yl)-1,2-oxazol-5-yl]-2,6-dimethoxybenzenecarbothioamide Traditional Name: N-[3-(1,1-diethylheptyl)isoxazol-5-yl]-2,6-dimethoxy-thiobenzamide Formula: C23H34N2O3S MolecularWeight: 418.59266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34N2O3S/c1-6-9-10-11-15-23(7-2,8-3)19-16-20(28-25-19)24-22(29)21-17(26-4)13-12-14-18(21)27-5/h12-14,16H,6-11,15H2,1-5H3,(H,24,29)