2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)ethanamide

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)ethanamide Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-N-[3-(1-pyrrolidinyl)-2-quinoxalinyl]acetamide IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-N-(3-pyrrolidinoquinoxalin-2-yl)acetamide Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC(=O)NC2=NC3=CC=CC=C3N=C2N4CCCC4

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC(=O)NC2=NC3=CC=CC=C3N=C2N4CCCC4

InChI

InChI=1S/C20H23N5O2S/c1-13-15(14(2)27-24-13)11-28-12-18(26)23-19-20(25-9-5-6-10-25)22-17-8-4-3-7-16(17)21-19/h3-4,7-8H,5-6,9-12H2,1-2H3,(H,21,23,26)