2,4-dimethoxy-5-methyl-6-nonyl-3-pyrrolidin-3-yl-benzenecarbothioamide

Systemtic Name: 2,4-dimethoxy-5-methyl-6-nonyl-3-pyrrolidin-3-yl-benzenecarbothioamide Openeye Name: 2,4-dimethoxy-5-methyl-6-nonyl-3-pyrrolidin-3-yl-benzenecarbothioamide CAS Name: 2,4-dimethoxy-5-methyl-6-nonyl-3-(3-pyrrolidinyl)benzenecarbothioamide IUPAC Name: 2,4-dimethoxy-5-methyl-6-nonyl-3-pyrrolidin-3-ylbenzenecarbothioamide Traditional Name: 2,4-dimethoxy-5-methyl-6-nonyl-3-pyrrolidin-3-yl-thiobenzamide Formula: C23H38N2O2S MolecularWeight: 406.62502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=C(C(=C1C)OC)C2CCNC2)OC)C(=S)N

Isomeric SMILES

CCCCCCCCCC1=C(C(=C(C(=C1C)OC)C2CCNC2)OC)C(=S)N

InChI

InChI=1S/C23H38N2O2S/c1-5-6-7-8-9-10-11-12-18-16(2)21(26-3)19(17-13-14-25-15-17)22(27-4)20(18)23(24)28/h17,25H,5-15H2,1-4H3,(H2,24,28)