N-(3-cyano-1-phenethyl-pyrrolidin-3-yl)-3-cyclohexyl-2-[[methylsulfonylamino(morpholin-4-yl)methylidene]amino]propanamide

Systemtic Name: N-(3-cyano-1-phenethyl-pyrrolidin-3-yl)-3-cyclohexyl-2-[[methylsulfonylamino(morpholin-4-yl)methylidene]amino]propanamide Openeye Name: N-(3-cyano-1-phenethyl-pyrrolidin-3-yl)-3-cyclohexyl-2-[[methanesulfonamido(morpholino)methylene]amino]propanamide CAS Name: N-(3-cyano-1-phenethyl-3-pyrrolidinyl)-3-cyclohexyl-2-[[methanesulfonamido(4-morpholinyl)methylidene]amino]propanamide IUPAC Name: N-(3-cyano-1-phenethylpyrrolidin-3-yl)-3-cyclohexyl-2-[[methanesulfonamido(morpholin-4-yl)methylidene]amino]propanamide Traditional Name: N-(3-cyano-1-phenethyl-pyrrolidin-3-yl)-3-cyclohexyl-2-[[methanesulfonamido(morpholino)methylene]amino]propionamide Formula: C28H42N6O4S MolecularWeight: 558.73588

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC(=NC(CC1CCCCC1)C(=O)NC2(CCN(C2)CCC3=CC=CC=C3)C#N)N4CCOCC4

Isomeric SMILES

CS(=O)(=O)NC(=NC(CC1CCCCC1)C(=O)NC2(CCN(C2)CCC3=CC=CC=C3)C#N)N4CCOCC4

InChI

InChI=1S/C28H42N6O4S/c1-39(36,37)32-27(34-16-18-38-19-17-34)30-25(20-24-10-6-3-7-11-24)26(35)31-28(21-29)13-15-33(22-28)14-12-23-8-4-2-5-9-23/h2,4-5,8-9,24-25H,3,6-7,10-20,22H2,1H3,(H,30,32)(H,31,35)