3-[2-[(4-methylsulfanylphenyl)methyl]-5-oxidanylidene-pyrrolidin-2-yl]-N-[(1-morpholin-4-ylcycloheptyl)methyl]propanamide

Systemtic Name: 3-[2-[(4-methylsulfanylphenyl)methyl]-5-oxidanylidene-pyrrolidin-2-yl]-N-[(1-morpholin-4-ylcycloheptyl)methyl]propanamide Openeye Name: 3-[2-[(4-methylsulfanylphenyl)methyl]-5-oxo-pyrrolidin-2-yl]-N-[(1-morpholinocycloheptyl)methyl]propanamide CAS Name: 3-[2-[[4-(methylthio)phenyl]methyl]-5-oxo-2-pyrrolidinyl]-N-[[1-(4-morpholinyl)cycloheptyl]methyl]propanamide IUPAC Name: 3-[2-[(4-methylsulfanylphenyl)methyl]-5-oxopyrrolidin-2-yl]-N-[(1-morpholin-4-ylcycloheptyl)methyl]propanamide Traditional Name: 3-[5-keto-2-[4-(methylthio)benzyl]pyrrolidin-2-yl]-N-[(1-morpholinocycloheptyl)methyl]propionamide Formula: C27H41N3O3S MolecularWeight: 487.69774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CC2(CCC(=O)N2)CCC(=O)NCC3(CCCCCC3)N4CCOCC4

Isomeric SMILES

CSC1=CC=C(C=C1)CC2(CCC(=O)N2)CCC(=O)NCC3(CCCCCC3)N4CCOCC4

InChI

InChI=1S/C27H41N3O3S/c1-34-23-8-6-22(7-9-23)20-26(15-11-25(32)29-26)14-10-24(31)28-21-27(12-4-2-3-5-13-27)30-16-18-33-19-17-30/h6-9H,2-5,10-21H2,1H3,(H,28,31)(H,29,32)