N-[3-methyl-4-[(3-methylsulfonylphenyl)carbonylamino]phenyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[3-methyl-4-[(3-methylsulfonylphenyl)carbonylamino]phenyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[3-methyl-4-[(3-methylsulfonylbenzoyl)amino]phenyl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-methyl-4-[[(3-methylsulfonylphenyl)-oxomethyl]amino]phenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-methyl-4-[(3-methylsulfonylbenzoyl)amino]phenyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[4-[(3-mesylbenzoyl)amino]-3-methyl-phenyl]-5-nitro-2-furamide Formula: C20H17N3O7S MolecularWeight: 443.42988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C20H17N3O7S/c1-12-10-14(21-20(25)17-8-9-18(30-17)23(26)27)6-7-16(12)22-19(24)13-4-3-5-15(11-13)31(2,28)29/h3-11H,1-2H3,(H,21,25)(H,22,24)