2-(2-methylphenyl)sulfanyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)ethanamide

Systemtic Name: 2-(2-methylphenyl)sulfanyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)ethanamide Openeye Name: 2-(o-tolylsulfanyl)-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide CAS Name: 2-[(2-methylphenyl)thio]-N-[3-(1-pyrrolidinyl)-2-quinoxalinyl]acetamide IUPAC Name: 2-(2-methylphenyl)sulfanyl-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide Traditional Name: 2-(o-tolylthio)-N-(3-pyrrolidinoquinoxalin-2-yl)acetamide Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)NC2=NC3=CC=CC=C3N=C2N4CCCC4

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)NC2=NC3=CC=CC=C3N=C2N4CCCC4

InChI

InChI=1S/C21H22N4OS/c1-15-8-2-5-11-18(15)27-14-19(26)24-20-21(25-12-6-7-13-25)23-17-10-4-3-9-16(17)22-20/h2-5,8-11H,6-7,12-14H2,1H3,(H,22,24,26)