N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-5-nitro-benzothiophene-2-carboxamide Formula: C20H15N5O5S2 MolecularWeight: 469.4936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N5O5S2/c1-12-8-9-21-20(22-12)24-32(29,30)16-5-2-14(3-6-16)23-19(26)18-11-13-10-15(25(27)28)4-7-17(13)31-18/h2-11H,1H3,(H,23,26)(H,21,22,24)