2,6-diethoxy-N-[5-(1-methylcyclopropyl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide

Systemtic Name: 2,6-diethoxy-N-[5-(1-methylcyclopropyl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide Openeye Name: 2,6-diethoxy-N-[5-(1-methylcyclopropyl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide CAS Name: 2,6-diethoxy-N-[5-(1-methylcyclopropyl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide IUPAC Name: 2,6-diethoxy-N-[5-(1-methylcyclopropyl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide Traditional Name: 2,6-diethoxy-N-[5-(1-methylcyclopropyl)-1,3,4-thiadiazol-2-yl]thiobenzamide Formula: C17H21N3O2S2 MolecularWeight: 363.49754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC=C1)OCC)C(=S)NC2=NN=C(S2)C3(CC3)C

Isomeric SMILES

CCOC1=C(C(=CC=C1)OCC)C(=S)NC2=NN=C(S2)C3(CC3)C

InChI

InChI=1S/C17H21N3O2S2/c1-4-21-11-7-6-8-12(22-5-2)13(11)14(23)18-16-20-19-15(24-16)17(3)9-10-17/h6-8H,4-5,9-10H2,1-3H3,(H,18,20,23)