N-[3-[[3-chloranyl-4-[(3-methylsulfonylphenyl)carbonylamino]phenyl]amino]-3-oxidanylidene-propyl]furan-2-carboxamide

Systemtic Name: N-[3-[[3-chloranyl-4-[(3-methylsulfonylphenyl)carbonylamino]phenyl]amino]-3-oxidanylidene-propyl]furan-2-carboxamide Openeye Name: N-[3-[3-chloro-4-[(3-methylsulfonylbenzoyl)amino]anilino]-3-oxo-propyl]furan-2-carboxamide CAS Name: N-[3-[3-chloro-4-[[(3-methylsulfonylphenyl)-oxomethyl]amino]anilino]-3-oxopropyl]-2-furancarboxamide IUPAC Name: N-[3-[3-chloro-4-[(3-methylsulfonylbenzoyl)amino]anilino]-3-oxopropyl]furan-2-carboxamide Traditional Name: N-[3-[3-chloro-4-[(3-mesylbenzoyl)amino]anilino]-3-keto-propyl]-2-furamide Formula: C22H20ClN3O6S MolecularWeight: 489.9287

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)CCNC(=O)C3=CC=CO3)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)CCNC(=O)C3=CC=CO3)Cl

InChI

InChI=1S/C22H20ClN3O6S/c1-33(30,31)16-5-2-4-14(12-16)21(28)26-18-8-7-15(13-17(18)23)25-20(27)9-10-24-22(29)19-6-3-11-32-19/h2-8,11-13H,9-10H2,1H3,(H,24,29)(H,25,27)(H,26,28)