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

Systemtic Name: 2-azanyl-N8,N8-diethyl-7-isocyanato-6-oxidanyl-4-oxidanylidene-N3-(phenylsulfamoyl)-1H-pyrrolo[1,2-a]pyrimidine-3,8-dicarboxamide Openeye Name: 2-amino-N8,N8-diethyl-6-hydroxy-7-isocyanato-4-oxo-N3-(phenylsulfamoyl)-1H-pyrrolo[1,2-a]pyrimidine-3,8-dicarboxamide CAS Name: 2-amino-N8,N8-diethyl-6-hydroxy-7-isocyanato-4-oxo-N3-(phenylsulfamoyl)-1H-pyrrolo[1,2-a]pyrimidine-3,8-dicarboxamide IUPAC Name: 2-amino-8-N,8-N-diethyl-6-hydroxy-7-isocyanato-4-oxo-3-N-(phenylsulfamoyl)-1H-pyrrolo[1,2-a]pyrimidine-3,8-dicarboxamide Traditional Name: 2-amino-N',N'-diethyl-6-hydroxy-7-isocyanato-4-keto-N-(phenylsulfamoyl)-1H-pyrrolo[1,2-a]pyrimidine-3,8-dicarboxamide Formula: C20H21N7O7S MolecularWeight: 503.48844

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C2NC(=C(C(=O)N2C(=C1N=C=O)O)C(=O)NS(=O)(=O)NC3=CC=CC=C3)N

Isomeric SMILES

CCN(CC)C(=O)C1=C2NC(=C(C(=O)N2C(=C1N=C=O)O)C(=O)NS(=O)(=O)NC3=CC=CC=C3)N

InChI

InChI=1S/C20H21N7O7S/c1-3-26(4-2)18(30)12-14(22-10-28)20(32)27-16(12)23-15(21)13(19(27)31)17(29)25-35(33,34)24-11-8-6-5-7-9-11/h5-9,23-24,32H,3-4,21H2,1-2H3,(H,25,29)