N-[(4-methylsulfanylphenyl)methyl]-2-(6-oxidanylidene-3-pyrrolidin-1-ylcarbonyl-7,8,9,10-tetrahydro-6aH-pyrido[1,2-a]quinoxalin-5-yl)ethanamide

Systemtic Name: N-[(4-methylsulfanylphenyl)methyl]-2-(6-oxidanylidene-3-pyrrolidin-1-ylcarbonyl-7,8,9,10-tetrahydro-6aH-pyrido[1,2-a]quinoxalin-5-yl)ethanamide Openeye Name: N-[(4-methylsulfanylphenyl)methyl]-2-[6-oxo-3-(pyrrolidine-1-carbonyl)-7,8,9,10-tetrahydro-6aH-pyrido[1,2-a]quinoxalin-5-yl]acetamide CAS Name: N-[[4-(methylthio)phenyl]methyl]-2-[6-oxo-3-[oxo(1-pyrrolidinyl)methyl]-7,8,9,10-tetrahydro-6aH-pyrido[1,2-a]quinoxalin-5-yl]acetamide IUPAC Name: N-[(4-methylsulfanylphenyl)methyl]-2-[6-oxo-3-(pyrrolidine-1-carbonyl)-7,8,9,10-tetrahydro-6aH-pyrido[1,2-a]quinoxalin-5-yl]acetamide Traditional Name: 2-[6-keto-3-(pyrrolidine-1-carbonyl)-7,8,9,10-tetrahydro-6aH-pyrido[1,2-a]quinoxalin-5-yl]-N-[4-(methylthio)benzyl]acetamide Formula: C27H32N4O3S MolecularWeight: 492.63298

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)CN2C3=C(C=CC(=C3)C(=O)N4CCCC4)N5CCCCC5C2=O

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)CN2C3=C(C=CC(=C3)C(=O)N4CCCC4)N5CCCCC5C2=O

InChI

InChI=1S/C27H32N4O3S/c1-35-21-10-7-19(8-11-21)17-28-25(32)18-31-24-16-20(26(33)29-13-4-5-14-29)9-12-22(24)30-15-3-2-6-23(30)27(31)34/h7-12,16,23H,2-6,13-15,17-18H2,1H3,(H,28,32)