N-(2-ethyl-6-methyl-phenyl)-3-phenyl-pyrrolidine-1-carbothioamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-3-phenyl-pyrrolidine-1-carbothioamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-3-phenyl-pyrrolidine-1-carbothioamide CAS Name: N-(2-ethyl-6-methylphenyl)-3-phenyl-1-pyrrolidinecarbothioamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-3-phenylpyrrolidine-1-carbothioamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-3-phenyl-pyrrolidine-1-carbothioamide Formula: C20H24N2S MolecularWeight: 324.48296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)N2CCC(C2)C3=CC=CC=C3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)N2CCC(C2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H24N2S/c1-3-16-11-7-8-15(2)19(16)21-20(23)22-13-12-18(14-22)17-9-5-4-6-10-17/h4-11,18H,3,12-14H2,1-2H3,(H,21,23)