2-(phenylmethylsulfanyl)-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)ethanamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide CAS Name: 2-(phenylmethylthio)-N-[3-(1-pyrrolidinyl)-2-quinoxalinyl]acetamide IUPAC Name: 2-benzylsulfanyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide Traditional Name: 2-(benzylthio)-N-(3-pyrrolidinoquinoxalin-2-yl)acetamide Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=CC=CC=C3N=C2NC(=O)CSCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=NC3=CC=CC=C3N=C2NC(=O)CSCC4=CC=CC=C4

InChI

InChI=1S/C21H22N4OS/c26-19(15-27-14-16-8-2-1-3-9-16)24-20-21(25-12-6-7-13-25)23-18-11-5-4-10-17(18)22-20/h1-5,8-11H,6-7,12-15H2,(H,22,24,26)