N-(2-tert-butylsulfanylethyl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-tert-butylsulfanylethyl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-tert-butylsulfanylethyl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(tert-butylthio)ethyl]-2-methyl-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2-tert-butylsulfanylethyl)-2-methyl-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(tert-butylthio)ethyl]-2-methyl-5-pyrrolidinosulfonyl-benzamide Formula: C18H28N2O3S2 MolecularWeight: 384.55652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCCSC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCCSC(C)(C)C

InChI

InChI=1S/C18H28N2O3S2/c1-14-7-8-15(25(22,23)20-10-5-6-11-20)13-16(14)17(21)19-9-12-24-18(2,3)4/h7-8,13H,5-6,9-12H2,1-4H3,(H,19,21)