5-(tert-butylamino)-3-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-(tert-butylamino)-3-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 5-(tert-butylamino)-3-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 5-(tert-butylamino)-3-[[2-(4-ethoxyphenyl)-1-pyrrolidinyl]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(tert-butylamino)-3-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 5-(tert-butylamino)-3-[(2-p-phenetylpyrrolidino)methyl]-1,3,4-thiadiazole-2-thione Formula: C19H28N4OS2 MolecularWeight: 392.58182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2CN3C(=S)SC(=N3)NC(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2CN3C(=S)SC(=N3)NC(C)(C)C

InChI

InChI=1S/C19H28N4OS2/c1-5-24-15-10-8-14(9-11-15)16-7-6-12-22(16)13-23-18(25)26-17(21-23)20-19(2,3)4/h8-11,16H,5-7,12-13H2,1-4H3,(H,20,21)