2-azanyl-N8,N8-diethyl-7-methyl-6-methylsulfanyl-4-oxidanylidene-N3-(phenylsulfamoyl)-1H-pyrrolo[1,2-a]pyrimidine-3,8-dicarboxamide

Systemtic Name: 2-azanyl-N8,N8-diethyl-7-methyl-6-methylsulfanyl-4-oxidanylidene-N3-(phenylsulfamoyl)-1H-pyrrolo[1,2-a]pyrimidine-3,8-dicarboxamide Openeye Name: 2-amino-N8,N8-diethyl-7-methyl-6-methylsulfanyl-4-oxo-N3-(phenylsulfamoyl)-1H-pyrrolo[1,2-a]pyrimidine-3,8-dicarboxamide CAS Name: 2-amino-N8,N8-diethyl-7-methyl-6-(methylthio)-4-oxo-N3-(phenylsulfamoyl)-1H-pyrrolo[1,2-a]pyrimidine-3,8-dicarboxamide IUPAC Name: 2-amino-8-N,8-N-diethyl-7-methyl-6-methylsulfanyl-4-oxo-3-N-(phenylsulfamoyl)-1H-pyrrolo[1,2-a]pyrimidine-3,8-dicarboxamide Traditional Name: 2-amino-N',N'-diethyl-4-keto-7-methyl-6-(methylthio)-N-(phenylsulfamoyl)-1H-pyrrolo[1,2-a]pyrimidine-3,8-dicarboxamide Formula: C21H26N6O5S2 MolecularWeight: 506.59834

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C2NC(=C(C(=O)N2C(=C1C)SC)C(=O)NS(=O)(=O)NC3=CC=CC=C3)N

Isomeric SMILES

CCN(CC)C(=O)C1=C2NC(=C(C(=O)N2C(=C1C)SC)C(=O)NS(=O)(=O)NC3=CC=CC=C3)N

InChI

InChI=1S/C21H26N6O5S2/c1-5-26(6-2)19(29)14-12(3)21(33-4)27-17(14)23-16(22)15(20(27)30)18(28)25-34(31,32)24-13-10-8-7-9-11-13/h7-11,23-24H,5-6,22H2,1-4H3,(H,25,28)