N-[3-(1-ethylcycloheptyl)-1,2,4-oxadiazol-5-yl]-2,4,5-trimethoxy-benzenecarbothioamide

Systemtic Name: N-[3-(1-ethylcycloheptyl)-1,2,4-oxadiazol-5-yl]-2,4,5-trimethoxy-benzenecarbothioamide Openeye Name: N-[3-(1-ethylcycloheptyl)-1,2,4-oxadiazol-5-yl]-2,4,5-trimethoxy-benzenecarbothioamide CAS Name: N-[3-(1-ethylcycloheptyl)-1,2,4-oxadiazol-5-yl]-2,4,5-trimethoxybenzenecarbothioamide IUPAC Name: N-[3-(1-ethylcycloheptyl)-1,2,4-oxadiazol-5-yl]-2,4,5-trimethoxybenzenecarbothioamide Traditional Name: N-[3-(1-ethylcycloheptyl)-1,2,4-oxadiazol-5-yl]-2,4,5-trimethoxy-thiobenzamide Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCCCC1)C2=NOC(=N2)NC(=S)C3=CC(=C(C=C3OC)OC)OC

Isomeric SMILES

CCC1(CCCCCC1)C2=NOC(=N2)NC(=S)C3=CC(=C(C=C3OC)OC)OC

InChI

InChI=1S/C21H29N3O4S/c1-5-21(10-8-6-7-9-11-21)19-23-20(28-24-19)22-18(29)14-12-16(26-3)17(27-4)13-15(14)25-2/h12-13H,5-11H2,1-4H3,(H,22,23,24,29)