2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]ethanamide

Systemtic Name: 2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]ethanamide Openeye Name: 2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide CAS Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]acetamide IUPAC Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide Traditional Name: 2-(N-mesyl-2-methoxy-5-nitro-anilino)-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide Formula: C21H22N6O8S2 MolecularWeight: 550.56478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CN(C3=C(C=CC(=C3)[N+](=O)[O-])OC)S(=O)(=O)C

Isomeric SMILES

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CN(C3=C(C=CC(=C3)[N+](=O)[O-])OC)S(=O)(=O)C

InChI

InChI=1S/C21H22N6O8S2/c1-14-10-11-22-21(23-14)25-37(33,34)17-7-4-15(5-8-17)24-20(28)13-26(36(3,31)32)18-12-16(27(29)30)6-9-19(18)35-2/h4-12H,13H2,1-3H3,(H,24,28)(H,22,23,25)