N-(3-propan-2-yloxypropyl)-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(3-propan-2-yloxypropyl)-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-ethanamide Openeye Name: N-(3-isopropoxypropyl)-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-acetamide CAS Name: N-(3-propan-2-yloxypropyl)-2-[[4-(1-pyrrolidinylsulfonyl)phenyl]thio]acetamide IUPAC Name: N-(3-propan-2-yloxypropyl)-2-(4-pyrrolidin-1-ylsulfonylphenyl)sulfanylacetamide Traditional Name: N-(3-isopropoxypropyl)-2-[(4-pyrrolidinosulfonylphenyl)thio]acetamide Formula: C18H28N2O4S2 MolecularWeight: 400.55592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)CSC1=CC=C(C=C1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(C)OCCCNC(=O)CSC1=CC=C(C=C1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C18H28N2O4S2/c1-15(2)24-13-5-10-19-18(21)14-25-16-6-8-17(9-7-16)26(22,23)20-11-3-4-12-20/h6-9,15H,3-5,10-14H2,1-2H3,(H,19,21)