ethyl 2-[[4-(dimethylsulfamoyl)phenyl]carbonylamino]-1-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: ethyl 2-[[4-(dimethylsulfamoyl)phenyl]carbonylamino]-1-prop-2-enyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 1-allyl-2-[[4-(dimethylsulfamoyl)benzoyl]amino]pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-[[[4-(dimethylsulfamoyl)phenyl]-oxomethyl]amino]-1-prop-2-enyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(dimethylsulfamoyl)benzoyl]amino]-1-prop-2-enylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 1-allyl-2-[[4-(dimethylsulfamoyl)benzoyl]amino]pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C25H25N5O5S MolecularWeight: 507.5615

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC=C)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N(C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CC=C)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N(C)C

InChI

InChI=1S/C25H25N5O5S/c1-5-15-30-22(28-24(31)16-11-13-17(14-12-16)36(33,34)29(3)4)20(25(32)35-6-2)21-23(30)27-19-10-8-7-9-18(19)26-21/h5,7-14H,1,6,15H2,2-4H3,(H,28,31)